2-(cyclopropanecarbonylamino)-N-(4-methoxy-3-pyridinyl)pyridine-4-carboxamide

C16H16N4O3 — CID 117072455

IUPAC2-(cyclopropanecarbonylamino)-N-(4-methoxy-3-pyridinyl)pyridine-4-carboxamide
SMILESCOc1ccncc1NC(=O)c1ccnc(NC(=O)C2CC2)c1
InChIInChI=1S/C16H16N4O3/c1-23-13-5-6-17-9-12(13)19-16(22)11-4-7-18-14(8-11)20-15(21)10-2-3-10/h4-10H,2-3H2,1H3,(H,19,22)(H,18,20,21)
InChIKeyNZMAVPMPPORZNT-UHFFFAOYSA-N
MW312.33 g/mol
LogP2.09
Rot. Bonds5

About 2-(cyclopropanecarbonylamino)-N-(4-methoxy-3-pyridinyl)pyridine-4-carboxamide

2-(cyclopropanecarbonylamino)-N-(4-methoxy-3-pyridinyl)pyridine-4-carboxamide (PubChem CID 117072455) has the molecular formula C16H16N4O3 and a molecular weight of 312.33 g/mol. Its IUPAC name is 2-(cyclopropanecarbonylamino)-N-(4-methoxy-3-pyridinyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(cyclopropanecarbonylamino)-N-(4-methoxy-3-pyridinyl)pyridine-4-carboxamide
PubChem CID117072455
Molecular FormulaC16H16N4O3
Molecular Weight312.33 g/mol
Exact Mass312.12
IUPAC Name2-(cyclopropanecarbonylamino)-N-(4-methoxy-3-pyridinyl)pyridine-4-carboxamide
SMILESCOc1ccncc1NC(=O)c1ccnc(NC(=O)C2CC2)c1
InChIInChI=1S/C16H16N4O3/c1-23-13-5-6-17-9-12(13)19-16(22)11-4-7-18-14(8-11)20-15(21)10-2-3-10/h4-10H,2-3H2,1H3,(H,19,22)(H,18,20,21)
InChIKeyNZMAVPMPPORZNT-UHFFFAOYSA-N
XLogP2.09
TPSA93.21 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.33
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(cyclopropanecarbonylamino)-N-[5-[[1-[(4-fluorophenyl)methyl]piperidin-4-yl]methoxy]-3-pyridinyl]pyridine-4-carboxamide
CID 164623938
N-[5-[(1-benzylpiperidin-4-yl)methoxy]-3-pyridinyl]-2-(cyclopropanecarbonylamino)pyridine-4-carboxamide
CID 164618753
N-(2-amino-3-pyridinyl)-2-(cyclopropanecarbonylamino)pyridine-4-carboxamide
CID 155516197
N-[5-(1-benzylpiperidin-4-yl)oxy-3-pyridinyl]-2-(cyclopropanecarbonylamino)pyridine-4-carboxamide
CID 164615192
2-(cyclopropanecarbonylamino)-N-[5-[[1-[(2-fluorophenyl)methyl]piperidin-4-yl]methoxy]-3-pyridinyl]pyridine-4-carboxamide
CID 164620065
2-acetamido-N-[5-[[1-[(4-fluorophenyl)methyl]piperidin-4-yl]methoxy]-3-pyridinyl]pyridine-4-carboxamide
CID 164628497
N11-Ethyl-4-methoxy-5,11-dihydro-6H-dipyrido(3,2-b:2',3'-e)(1,4)diazepin-6-one
CID 453336
N-[6-(Cyclopropanecarbonyl-amino)-pyridin-3-yl]-isonicotinamide
CID 653903
N-[4-methyl-6-(1-oxobutylamino)-3-pyridinyl]-4-pyridinecarboxamide
CID 655201
2-(2-methylpropanoylamino)-N-[4-(2,2,2-trifluoroethoxy)pyridin-3-yl]pyridine-4-carboxamide
CID 91758299
2-(cyclopropanecarbonylamino)-N-(5-phenoxy-3-pyridinyl)pyridine-4-carboxamide
CID 118064282
N-(4-acetyl-3-pyridinyl)-2-(cyclopropanecarbonylamino)pyridine-4-carboxamide
CID 118064610

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropanecarbonylamino)-N-(4-methoxy-3-pyridinyl)pyridine-4-carboxamide?
The IUPAC name of 2-(cyclopropanecarbonylamino)-N-(4-methoxy-3-pyridinyl)pyridine-4-carboxamide (CID 117072455) is 2-(cyclopropanecarbonylamino)-N-(4-methoxy-3-pyridinyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(cyclopropanecarbonylamino)-N-(4-methoxy-3-pyridinyl)pyridine-4-carboxamide?
The canonical SMILES for 2-(cyclopropanecarbonylamino)-N-(4-methoxy-3-pyridinyl)pyridine-4-carboxamide is COc1ccncc1NC(=O)c1ccnc(NC(=O)C2CC2)c1.
What is the InChIKey of 2-(cyclopropanecarbonylamino)-N-(4-methoxy-3-pyridinyl)pyridine-4-carboxamide?
The InChIKey is NZMAVPMPPORZNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O3/c1-23-13-5-6-17-9-12(13)19-16(22)11-4-7-18-14(8-11)20-15(21)10-2-3-10/h4-10H,2-3H2,1H3,(H,19,22)(H,18,20,21).
What are the key properties of 2-(cyclopropanecarbonylamino)-N-(4-methoxy-3-pyridinyl)pyridine-4-carboxamide?
2-(cyclopropanecarbonylamino)-N-(4-methoxy-3-pyridinyl)pyridine-4-carboxamide has a molecular weight of 312.33 g/mol, XLogP of 2.09, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropanecarbonylamino)-N-(4-methoxy-3-pyridinyl)pyridine-4-carboxamide is sourced from PubChem (CID 117072455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).