N-cyclopentyl-2-[2-methylpropyl(pyridin-2-ylmethyl)amino]propanamide

C18H29N3O — CID 50963305

IUPACN-cyclopentyl-2-[2-methylpropyl(pyridin-2-ylmethyl)amino]propanamide
SMILESCC(C)CN(Cc1ccccn1)C(C)C(=O)NC1CCCC1
InChIInChI=1S/C18H29N3O/c1-14(2)12-21(13-17-10-6-7-11-19-17)15(3)18(22)20-16-8-4-5-9-16/h6-7,10-11,14-16H,4-5,8-9,12-13H2,1-3H3,(H,20,22)
InChIKeyIASBSGMWBARCJD-UHFFFAOYSA-N
MW303.45 g/mol
LogP2.99
Rot. Bonds7

About N-cyclopentyl-2-[2-methylpropyl(pyridin-2-ylmethyl)amino]propanamide

N-cyclopentyl-2-[2-methylpropyl(pyridin-2-ylmethyl)amino]propanamide (PubChem CID 50963305) has the molecular formula C18H29N3O and a molecular weight of 303.45 g/mol. Its IUPAC name is N-cyclopentyl-2-[2-methylpropyl(pyridin-2-ylmethyl)amino]propanamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[2-methylpropyl(pyridin-2-ylmethyl)amino]propanamide
PubChem CID50963305
Molecular FormulaC18H29N3O
Molecular Weight303.45 g/mol
Exact Mass303.23
IUPAC NameN-cyclopentyl-2-[2-methylpropyl(pyridin-2-ylmethyl)amino]propanamide
SMILESCC(C)CN(Cc1ccccn1)C(C)C(=O)NC1CCCC1
InChIInChI=1S/C18H29N3O/c1-14(2)12-21(13-17-10-6-7-11-19-17)15(3)18(22)20-16-8-4-5-9-16/h6-7,10-11,14-16H,4-5,8-9,12-13H2,1-3H3,(H,20,22)
InChIKeyIASBSGMWBARCJD-UHFFFAOYSA-N
XLogP2.99
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.45
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopentyl-2-phenyl-3-pyridin-2-ylpropanamide
CID 110407019
2-[acetyl(pyridin-2-ylmethyl)amino]-N-cycloheptylacetamide
CID 113163426
3-[acetyl(pyridin-2-ylmethyl)amino]-N-cycloheptylpropanamide
CID 113120220
2-[bis(pyridin-2-ylmethyl)amino]propanoic acid;manganese(2+);hydrochloride
CID 25264863
(2S)-2-[bis(pyridin-2-ylmethyl)amino]-N,N-bis(pyridin-2-ylmethyl)propanamide
CID 102088447
N-cyclopentyl-3-pyridin-2-ylpropanamide
CID 78980134
2-methyl-3-[propan-2-yl(pyridin-2-ylmethyl)amino]propanoic acid
CID 82328653
N-cycloheptyl-3-pyridin-2-ylpropanamide
CID 110389210
3-[3-oxobutan-2-yl(pyridin-2-ylmethyl)amino]propanoic acid
CID 82329316
N'-cyclohexyl-N-(pyridin-2-ylmethyl)oxamide
CID 2844203
4-amino-N-cyclopropyl-3-[methyl(pyridin-2-ylmethyl)amino]butanamide
CID 66431406
N-cyclohexyl-2-[methyl(quinoxalin-2-ylmethyl)amino]propanamide
CID 91830643

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[2-methylpropyl(pyridin-2-ylmethyl)amino]propanamide?
The IUPAC name of N-cyclopentyl-2-[2-methylpropyl(pyridin-2-ylmethyl)amino]propanamide (CID 50963305) is N-cyclopentyl-2-[2-methylpropyl(pyridin-2-ylmethyl)amino]propanamide.
What is the SMILES notation for N-cyclopentyl-2-[2-methylpropyl(pyridin-2-ylmethyl)amino]propanamide?
The canonical SMILES for N-cyclopentyl-2-[2-methylpropyl(pyridin-2-ylmethyl)amino]propanamide is CC(C)CN(Cc1ccccn1)C(C)C(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-[2-methylpropyl(pyridin-2-ylmethyl)amino]propanamide?
The InChIKey is IASBSGMWBARCJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N3O/c1-14(2)12-21(13-17-10-6-7-11-19-17)15(3)18(22)20-16-8-4-5-9-16/h6-7,10-11,14-16H,4-5,8-9,12-13H2,1-3H3,(H,20,22).
What are the key properties of N-cyclopentyl-2-[2-methylpropyl(pyridin-2-ylmethyl)amino]propanamide?
N-cyclopentyl-2-[2-methylpropyl(pyridin-2-ylmethyl)amino]propanamide has a molecular weight of 303.45 g/mol, XLogP of 2.99, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[2-methylpropyl(pyridin-2-ylmethyl)amino]propanamide is sourced from PubChem (CID 50963305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).