5-[[(1R,2S)-2-aminocyclohexyl]amino]-3-[(5-methoxy-6-methyl-2-pyridinyl)amino]pyridine-2-carboxamide

C19H26N6O2 — CID 71547503

IUPAC5-[[(1R,2S)-2-aminocyclohexyl]amino]-3-[(5-methoxy-6-methyl-2-pyridinyl)amino]pyridine-2-carboxamide
SMILESCOc1ccc(Nc2cc(N[C@@H]3CCCC[C@@H]3N)cnc2C(N)=O)nc1C
InChIInChI=1S/C19H26N6O2/c1-11-16(27-2)7-8-17(23-11)25-15-9-12(10-22-18(15)19(21)26)24-14-6-4-3-5-13(14)20/h7-10,13-14,24H,3-6,20H2,1-2H3,(H2,21,26)(H,23,25)/t13-,14+/m0/s1
InChIKeyNBTZVDGQKFCPPI-UONOGXRCSA-N
MW370.46 g/mol
LogP2.32
Rot. Bonds6

About 5-[[(1R,2S)-2-aminocyclohexyl]amino]-3-[(5-methoxy-6-methyl-2-pyridinyl)amino]pyridine-2-carboxamide

5-[[(1R,2S)-2-aminocyclohexyl]amino]-3-[(5-methoxy-6-methyl-2-pyridinyl)amino]pyridine-2-carboxamide (PubChem CID 71547503) has the molecular formula C19H26N6O2 and a molecular weight of 370.46 g/mol. Its IUPAC name is 5-[[(1R,2S)-2-aminocyclohexyl]amino]-3-[(5-methoxy-6-methyl-2-pyridinyl)amino]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-[[(1R,2S)-2-aminocyclohexyl]amino]-3-[(5-methoxy-6-methyl-2-pyridinyl)amino]pyridine-2-carboxamide
PubChem CID71547503
Molecular FormulaC19H26N6O2
Molecular Weight370.46 g/mol
Exact Mass370.21
IUPAC Name5-[[(1R,2S)-2-aminocyclohexyl]amino]-3-[(5-methoxy-6-methyl-2-pyridinyl)amino]pyridine-2-carboxamide
SMILESCOc1ccc(Nc2cc(N[C@@H]3CCCC[C@@H]3N)cnc2C(N)=O)nc1C
InChIInChI=1S/C19H26N6O2/c1-11-16(27-2)7-8-17(23-11)25-15-9-12(10-22-18(15)19(21)26)24-14-6-4-3-5-13(14)20/h7-10,13-14,24H,3-6,20H2,1-2H3,(H2,21,26)(H,23,25)/t13-,14+/m0/s1
InChIKeyNBTZVDGQKFCPPI-UONOGXRCSA-N
XLogP2.32
TPSA128.18 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.46
LogP ≤ 52.32
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

Analyze 5-[[(1R,2S)-2-aminocyclohexyl]amino]-3-[(5-methoxy-6-methyl-2-pyridinyl)amino]pyridine-2-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

6-(ethylcarbamoylamino)-4-[(4-methoxyphenyl)amino]-~{N}-pyridin-3-yl-pyridine-3-carboxamide
CID 89650975
2-(3-(4-(2-Methoxyphenyl)piperazin-1-yl)propylamino)-N,N-dimethylnicotinamide
CID 9865577
2-[3-[4-(2-Methoxyphenyl)piperazin-1-yl]propylamino]pyridine-3-carboxamide
CID 10499343
5-[[(1R,2S)-2-aminocyclohexyl]amino]-3-[(4-methoxy-6-methyl-2-pyridinyl)amino]pyridine-2-carboxamide
CID 71547584
5-[[(3S,4S)-4-amino-1,1-dioxothian-3-yl]amino]-3-[(4-methoxy-6-methyl-2-pyridinyl)amino]pyridine-2-carboxamide
CID 71548006
3-amino-N-[3-(4-aminopiperidin-1-yl)pyridin-2-yl]-6-[3-(trifluoromethoxy)pyridin-2-yl]pyrazine-2-carboxamide
CID 118873207
3-amino-N-[3-(4-amino-3-methoxypiperidin-1-yl)pyridin-2-yl]-6-[3-(trifluoromethoxy)pyridin-2-yl]pyrazine-2-carboxamide
CID 118873273
3-amino-N-[3-(4-amino-3-fluoropiperidin-1-yl)pyridin-2-yl]-6-[3-(trifluoromethoxy)pyridin-2-yl]pyrazine-2-carboxamide
CID 118873314
2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylamino]-N-methylpyridine-3-carboxamide
CID 10786203
N-[2-[4-(2-Methoxyphenyl)-1-piperazinyl]ethyl]-4-pyrimidinecarboxamide
CID 10640987
6-((1R,2S)-2-aminocyclohexylamino)-4-(5-methoxy-6-propylpyridin-2-ylamino)pyridazine-3-carboxamide
CID 71625975
6-((1R,2S)-2-aminocyclohexylamino)-4-(6-isopropyl-5-methoxypyridin-2-ylamino)pyridazine-3-carboxamide
CID 71626041

Frequently Asked Questions

What is the IUPAC name of 5-[[(1R,2S)-2-aminocyclohexyl]amino]-3-[(5-methoxy-6-methyl-2-pyridinyl)amino]pyridine-2-carboxamide?
The IUPAC name of 5-[[(1R,2S)-2-aminocyclohexyl]amino]-3-[(5-methoxy-6-methyl-2-pyridinyl)amino]pyridine-2-carboxamide (CID 71547503) is 5-[[(1R,2S)-2-aminocyclohexyl]amino]-3-[(5-methoxy-6-methyl-2-pyridinyl)amino]pyridine-2-carboxamide.
What is the SMILES notation for 5-[[(1R,2S)-2-aminocyclohexyl]amino]-3-[(5-methoxy-6-methyl-2-pyridinyl)amino]pyridine-2-carboxamide?
The canonical SMILES for 5-[[(1R,2S)-2-aminocyclohexyl]amino]-3-[(5-methoxy-6-methyl-2-pyridinyl)amino]pyridine-2-carboxamide is COc1ccc(Nc2cc(N[C@@H]3CCCC[C@@H]3N)cnc2C(N)=O)nc1C.
What is the InChIKey of 5-[[(1R,2S)-2-aminocyclohexyl]amino]-3-[(5-methoxy-6-methyl-2-pyridinyl)amino]pyridine-2-carboxamide?
The InChIKey is NBTZVDGQKFCPPI-UONOGXRCSA-N. The full InChI is InChI=1S/C19H26N6O2/c1-11-16(27-2)7-8-17(23-11)25-15-9-12(10-22-18(15)19(21)26)24-14-6-4-3-5-13(14)20/h7-10,13-14,24H,3-6,20H2,1-2H3,(H2,21,26)(H,23,25)/t13-,14+/m0/s1.
What are the key properties of 5-[[(1R,2S)-2-aminocyclohexyl]amino]-3-[(5-methoxy-6-methyl-2-pyridinyl)amino]pyridine-2-carboxamide?
5-[[(1R,2S)-2-aminocyclohexyl]amino]-3-[(5-methoxy-6-methyl-2-pyridinyl)amino]pyridine-2-carboxamide has a molecular weight of 370.46 g/mol, XLogP of 2.32, 6 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[(1R,2S)-2-aminocyclohexyl]amino]-3-[(5-methoxy-6-methyl-2-pyridinyl)amino]pyridine-2-carboxamide is sourced from PubChem (CID 71547503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).