N-cyclopentyl-3-[methyl(2-pyridin-4-ylethyl)amino]propanamide

C16H25N3O — CID 109013454

IUPACN-cyclopentyl-3-[methyl(2-pyridin-4-ylethyl)amino]propanamide
SMILESCN(CCC(=O)NC1CCCC1)CCc1ccncc1
InChIInChI=1S/C16H25N3O/c1-19(12-8-14-6-10-17-11-7-14)13-9-16(20)18-15-4-2-3-5-15/h6-7,10-11,15H,2-5,8-9,12-13H2,1H3,(H,18,20)
InChIKeyPBTIVMBFSCEYIS-UHFFFAOYSA-N
MW275.40 g/mol
LogP2.00
Rot. Bonds7

About N-cyclopentyl-3-[methyl(2-pyridin-4-ylethyl)amino]propanamide

N-cyclopentyl-3-[methyl(2-pyridin-4-ylethyl)amino]propanamide (PubChem CID 109013454) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is N-cyclopentyl-3-[methyl(2-pyridin-4-ylethyl)amino]propanamide.

Molecular Properties

Compound NameN-cyclopentyl-3-[methyl(2-pyridin-4-ylethyl)amino]propanamide
PubChem CID109013454
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC NameN-cyclopentyl-3-[methyl(2-pyridin-4-ylethyl)amino]propanamide
SMILESCN(CCC(=O)NC1CCCC1)CCc1ccncc1
InChIInChI=1S/C16H25N3O/c1-19(12-8-14-6-10-17-11-7-14)13-9-16(20)18-15-4-2-3-5-15/h6-7,10-11,15H,2-5,8-9,12-13H2,1H3,(H,18,20)
InChIKeyPBTIVMBFSCEYIS-UHFFFAOYSA-N
XLogP2.00
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-2-[methyl(2-pyridin-4-ylethyl)amino]acetamide
CID 108993655
N-cycloheptyl-N'-methyl-N'-(2-pyridin-4-ylethyl)propanediamide
CID 108948907
N-cyclopentyl-3-[methylsulfonyl(pyridin-4-ylmethyl)amino]propanamide
CID 113140010
3-[acetyl(pyridin-4-ylmethyl)amino]-N-cyclopropylpropanamide
CID 113120535
3-(cyclohexylamino)-N-methyl-N-(2-pyridin-4-ylethyl)propanamide
CID 109014143
2-(cyclopropylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butanamide
CID 63054235
2-N-cyclohexyl-1-N-methyl-1-N-(2-pyridin-4-ylethyl)cyclopropane-1,2-dicarboxamide
CID 109132403
N-(4-acetamidophenyl)-3-[methyl(2-pyridin-4-ylethyl)amino]propanamide
CID 109026239
N-cycloheptyl-5-[methyl(2-pyridin-4-ylethyl)amino]pyridine-3-carboxamide
CID 109237072
2-N-cycloheptyl-6-N-methyl-6-N-(2-pyridin-4-ylethyl)pyridine-2,6-dicarboxamide
CID 109098676
N-cycloheptyl-4-[methyl(2-pyridin-4-ylethyl)amino]pyridine-2-carboxamide
CID 109214735
N-methyl-3-[methyl(2-pyridin-4-ylethyl)amino]-N-(2-pyridin-4-ylethyl)propanamide
CID 109025999

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-[methyl(2-pyridin-4-ylethyl)amino]propanamide?
The IUPAC name of N-cyclopentyl-3-[methyl(2-pyridin-4-ylethyl)amino]propanamide (CID 109013454) is N-cyclopentyl-3-[methyl(2-pyridin-4-ylethyl)amino]propanamide.
What is the SMILES notation for N-cyclopentyl-3-[methyl(2-pyridin-4-ylethyl)amino]propanamide?
The canonical SMILES for N-cyclopentyl-3-[methyl(2-pyridin-4-ylethyl)amino]propanamide is CN(CCC(=O)NC1CCCC1)CCc1ccncc1.
What is the InChIKey of N-cyclopentyl-3-[methyl(2-pyridin-4-ylethyl)amino]propanamide?
The InChIKey is PBTIVMBFSCEYIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-19(12-8-14-6-10-17-11-7-14)13-9-16(20)18-15-4-2-3-5-15/h6-7,10-11,15H,2-5,8-9,12-13H2,1H3,(H,18,20).
What are the key properties of N-cyclopentyl-3-[methyl(2-pyridin-4-ylethyl)amino]propanamide?
N-cyclopentyl-3-[methyl(2-pyridin-4-ylethyl)amino]propanamide has a molecular weight of 275.40 g/mol, XLogP of 2.00, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-[methyl(2-pyridin-4-ylethyl)amino]propanamide is sourced from PubChem (CID 109013454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).