N-cyclohexyl-3-[[3-(pyrrolidine-1-carbonyl)-2-pyridinyl]amino]propanamide

C19H28N4O2 — CID 135089182

IUPACN-cyclohexyl-3-[[3-(pyrrolidine-1-carbonyl)-2-pyridinyl]amino]propanamide
SMILESO=C(CCNc1ncccc1C(=O)N1CCCC1)NC1CCCCC1
InChIInChI=1S/C19H28N4O2/c24-17(22-15-7-2-1-3-8-15)10-12-21-18-16(9-6-11-20-18)19(25)23-13-4-5-14-23/h6,9,11,15H,1-5,7-8,10,12-14H2,(H,20,21)(H,22,24)
InChIKeyJZKQIFOVKIWSSN-UHFFFAOYSA-N
MW344.46 g/mol
LogP2.57
Rot. Bonds6

About N-cyclohexyl-3-[[3-(pyrrolidine-1-carbonyl)-2-pyridinyl]amino]propanamide

N-cyclohexyl-3-[[3-(pyrrolidine-1-carbonyl)-2-pyridinyl]amino]propanamide (PubChem CID 135089182) has the molecular formula C19H28N4O2 and a molecular weight of 344.46 g/mol. Its IUPAC name is N-cyclohexyl-3-[[3-(pyrrolidine-1-carbonyl)-2-pyridinyl]amino]propanamide.

Molecular Properties

Compound NameN-cyclohexyl-3-[[3-(pyrrolidine-1-carbonyl)-2-pyridinyl]amino]propanamide
PubChem CID135089182
Molecular FormulaC19H28N4O2
Molecular Weight344.46 g/mol
Exact Mass344.22
IUPAC NameN-cyclohexyl-3-[[3-(pyrrolidine-1-carbonyl)-2-pyridinyl]amino]propanamide
SMILESO=C(CCNc1ncccc1C(=O)N1CCCC1)NC1CCCCC1
InChIInChI=1S/C19H28N4O2/c24-17(22-15-7-2-1-3-8-15)10-12-21-18-16(9-6-11-20-18)19(25)23-13-4-5-14-23/h6,9,11,15H,1-5,7-8,10,12-14H2,(H,20,21)(H,22,24)
InChIKeyJZKQIFOVKIWSSN-UHFFFAOYSA-N
XLogP2.57
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.46
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[3-(piperidine-1-carbonyl)-2-pyridinyl]amino]-N-propylacetamide
CID 133383039
(3-methylpiperidin-1-yl)-[2-(propylamino)-3-pyridinyl]methanone
CID 62172051
N-cyclopropyl-3-[(3-methylsulfonyl-2-pyridinyl)amino]propanamide
CID 114598969
(2-methylpiperidin-1-yl)-[2-(propylamino)-3-pyridinyl]methanone
CID 62172000
[2-[[1-(2-hydroxyethyl)cyclopropyl]methylamino]-3-pyridinyl]-piperidin-1-ylmethanone
CID 133496686
4-[(3-chloro-2-pyridinyl)amino]-N-cyclopropylbutanamide
CID 79401819
3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl-[2-(propylamino)-3-pyridinyl]methanone
CID 115561651
[2-[2-(3-methylpiperidin-1-yl)propylamino]-3-pyridinyl]-piperidin-1-ylmethanone
CID 133328244
[2-[(2-ethylsulfanyl-1-hydroxycyclobutyl)methylamino]-3-pyridinyl]-piperidin-1-ylmethanone
CID 133357871
propan-2-yl 4-[[3-(piperidine-1-carbonyl)-2-pyridinyl]amino]piperidine-1-carboxylate
CID 133352908
[2-[(2-hydroxy-2,3-dimethylpentyl)amino]-3-pyridinyl]-piperidin-1-ylmethanone
CID 133352672
[2-[[6-(azepan-1-yl)-3-pyridinyl]methylamino]-3-pyridinyl]-piperidin-1-ylmethanone
CID 133317596

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-[[3-(pyrrolidine-1-carbonyl)-2-pyridinyl]amino]propanamide?
The IUPAC name of N-cyclohexyl-3-[[3-(pyrrolidine-1-carbonyl)-2-pyridinyl]amino]propanamide (CID 135089182) is N-cyclohexyl-3-[[3-(pyrrolidine-1-carbonyl)-2-pyridinyl]amino]propanamide.
What is the SMILES notation for N-cyclohexyl-3-[[3-(pyrrolidine-1-carbonyl)-2-pyridinyl]amino]propanamide?
The canonical SMILES for N-cyclohexyl-3-[[3-(pyrrolidine-1-carbonyl)-2-pyridinyl]amino]propanamide is O=C(CCNc1ncccc1C(=O)N1CCCC1)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-3-[[3-(pyrrolidine-1-carbonyl)-2-pyridinyl]amino]propanamide?
The InChIKey is JZKQIFOVKIWSSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N4O2/c24-17(22-15-7-2-1-3-8-15)10-12-21-18-16(9-6-11-20-18)19(25)23-13-4-5-14-23/h6,9,11,15H,1-5,7-8,10,12-14H2,(H,20,21)(H,22,24).
What are the key properties of N-cyclohexyl-3-[[3-(pyrrolidine-1-carbonyl)-2-pyridinyl]amino]propanamide?
N-cyclohexyl-3-[[3-(pyrrolidine-1-carbonyl)-2-pyridinyl]amino]propanamide has a molecular weight of 344.46 g/mol, XLogP of 2.57, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-[[3-(pyrrolidine-1-carbonyl)-2-pyridinyl]amino]propanamide is sourced from PubChem (CID 135089182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).