N-(cyclopropylmethyl)-N-ethyl-2-(propylamino)pyridine-3-carboxamide

C15H23N3O — CID 63940110

IUPACN-(cyclopropylmethyl)-N-ethyl-2-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ncccc1C(=O)N(CC)CC1CC1
InChIInChI=1S/C15H23N3O/c1-3-9-16-14-13(6-5-10-17-14)15(19)18(4-2)11-12-7-8-12/h5-6,10,12H,3-4,7-9,11H2,1-2H3,(H,16,17)
InChIKeyCGEMHONFCMIQLC-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.78
Rot. Bonds7

About N-(cyclopropylmethyl)-N-ethyl-2-(propylamino)pyridine-3-carboxamide

N-(cyclopropylmethyl)-N-ethyl-2-(propylamino)pyridine-3-carboxamide (PubChem CID 63940110) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-N-ethyl-2-(propylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-N-ethyl-2-(propylamino)pyridine-3-carboxamide
PubChem CID63940110
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-(cyclopropylmethyl)-N-ethyl-2-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ncccc1C(=O)N(CC)CC1CC1
InChIInChI=1S/C15H23N3O/c1-3-9-16-14-13(6-5-10-17-14)15(19)18(4-2)11-12-7-8-12/h5-6,10,12H,3-4,7-9,11H2,1-2H3,(H,16,17)
InChIKeyCGEMHONFCMIQLC-UHFFFAOYSA-N
XLogP2.78
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclopentylmethyl)-2-(propylamino)pyridine-3-carboxamide
CID 62168476
N-methyl-N-(1-methylpiperidin-4-yl)-2-(propylamino)pyridine-3-carboxamide
CID 62165835
N-(cyclopropylmethyl)-N-ethyl-4-(propylamino)pyridine-2-carboxamide
CID 63939735
N-(cyclopropylmethyl)-N-ethyl-6-(propylamino)pyridine-2-carboxamide
CID 63938951
N-(cyclopropylmethyl)-N-methyl-2-(propylamino)pyridine-3-sulfonamide
CID 62146200
N-(cyclopropylmethyl)-N-ethyl-3-hydroxypyridine-2-carboxamide
CID 63955616
N-butyl-N-methyl-2-(propylamino)pyridine-3-carboxamide
CID 62186071
N-methyl-N-(2-methylbutan-2-yl)-2-(propylamino)pyridine-3-carboxamide
CID 63961871
2-(propylamino)pyridine-3-carboxylate
CID 22068597
N-methyl-N-(3-methylbutan-2-yl)-2-(propylamino)pyridine-3-carboxamide
CID 62168547
3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl-[2-(propylamino)-3-pyridinyl]methanone
CID 115561651
N-ethyl-N-(1-methoxypropan-2-yl)-2-(propylamino)pyridine-3-carboxamide
CID 62181530

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-N-ethyl-2-(propylamino)pyridine-3-carboxamide?
The IUPAC name of N-(cyclopropylmethyl)-N-ethyl-2-(propylamino)pyridine-3-carboxamide (CID 63940110) is N-(cyclopropylmethyl)-N-ethyl-2-(propylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(cyclopropylmethyl)-N-ethyl-2-(propylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(cyclopropylmethyl)-N-ethyl-2-(propylamino)pyridine-3-carboxamide is CCCNc1ncccc1C(=O)N(CC)CC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-N-ethyl-2-(propylamino)pyridine-3-carboxamide?
The InChIKey is CGEMHONFCMIQLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-3-9-16-14-13(6-5-10-17-14)15(19)18(4-2)11-12-7-8-12/h5-6,10,12H,3-4,7-9,11H2,1-2H3,(H,16,17).
What are the key properties of N-(cyclopropylmethyl)-N-ethyl-2-(propylamino)pyridine-3-carboxamide?
N-(cyclopropylmethyl)-N-ethyl-2-(propylamino)pyridine-3-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 2.78, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-N-ethyl-2-(propylamino)pyridine-3-carboxamide is sourced from PubChem (CID 63940110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).