N-(cyclopropylmethyl)-4-(ethylamino)-N-propylpyridine-3-carboxamide

C15H23N3O — CID 81242615

IUPACN-(cyclopropylmethyl)-4-(ethylamino)-N-propylpyridine-3-carboxamide
SMILESCCCN(CC1CC1)C(=O)c1cnccc1NCC
InChIInChI=1S/C15H23N3O/c1-3-9-18(11-12-5-6-12)15(19)13-10-16-8-7-14(13)17-4-2/h7-8,10,12H,3-6,9,11H2,1-2H3,(H,16,17)
InChIKeyPMDQMVJHHXRZQC-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.78
Rot. Bonds7

About N-(cyclopropylmethyl)-4-(ethylamino)-N-propylpyridine-3-carboxamide

N-(cyclopropylmethyl)-4-(ethylamino)-N-propylpyridine-3-carboxamide (PubChem CID 81242615) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-4-(ethylamino)-N-propylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-4-(ethylamino)-N-propylpyridine-3-carboxamide
PubChem CID81242615
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-(cyclopropylmethyl)-4-(ethylamino)-N-propylpyridine-3-carboxamide
SMILESCCCN(CC1CC1)C(=O)c1cnccc1NCC
InChIInChI=1S/C15H23N3O/c1-3-9-18(11-12-5-6-12)15(19)13-10-16-8-7-14(13)17-4-2/h7-8,10,12H,3-6,9,11H2,1-2H3,(H,16,17)
InChIKeyPMDQMVJHHXRZQC-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

3-chloro-N-(cyclopropylmethyl)-N-propylpyridine-4-carboxamide
CID 66482927
N-butyl-N-cyclopropyl-4-(ethylamino)pyridine-3-carboxamide
CID 81242322
N-(cyclohexylmethyl)-N-methyl-4-(propylamino)pyridine-3-carboxamide
CID 81238812
4-(ethylamino)-N-methyl-N-[(2-methylcyclopropyl)methyl]pyridine-3-carboxamide
CID 81241438
N-(2-hydroxyethyl)-4-(methylamino)-N-propylpyridine-3-carboxamide
CID 81242925
4-(ethylamino)-N-methyl-N-(oxan-3-ylmethyl)pyridine-3-carboxamide
CID 81242094
N-(cyclopentylmethyl)-4-(ethylamino)pyridine-3-carboxamide
CID 81236600
4-(ethylamino)-N-methyl-N-(oxan-4-yl)pyridine-3-carboxamide
CID 81243241
N-(cyclopropylmethyl)-N-ethyl-3-(methylamino)pyridine-4-carboxamide
CID 105070225
N-(cyclopropylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
CID 105068880
N-butan-2-yl-N-butyl-4-(ethylamino)pyridine-3-carboxamide
CID 81240030
4-[cyclopropylmethyl(ethyl)carbamoyl]pyridine-3-carboxylic acid
CID 114244404

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-4-(ethylamino)-N-propylpyridine-3-carboxamide?
The IUPAC name of N-(cyclopropylmethyl)-4-(ethylamino)-N-propylpyridine-3-carboxamide (CID 81242615) is N-(cyclopropylmethyl)-4-(ethylamino)-N-propylpyridine-3-carboxamide.
What is the SMILES notation for N-(cyclopropylmethyl)-4-(ethylamino)-N-propylpyridine-3-carboxamide?
The canonical SMILES for N-(cyclopropylmethyl)-4-(ethylamino)-N-propylpyridine-3-carboxamide is CCCN(CC1CC1)C(=O)c1cnccc1NCC.
What is the InChIKey of N-(cyclopropylmethyl)-4-(ethylamino)-N-propylpyridine-3-carboxamide?
The InChIKey is PMDQMVJHHXRZQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-3-9-18(11-12-5-6-12)15(19)13-10-16-8-7-14(13)17-4-2/h7-8,10,12H,3-6,9,11H2,1-2H3,(H,16,17).
What are the key properties of N-(cyclopropylmethyl)-4-(ethylamino)-N-propylpyridine-3-carboxamide?
N-(cyclopropylmethyl)-4-(ethylamino)-N-propylpyridine-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)-4-(ethylamino)-N-propylpyridine-3-carboxamide is sourced from PubChem (CID 81242615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).