2-(cyclopropylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butanamide

C15H24N4O — CID 63054235

IUPAC2-(cyclopropylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butanamide
SMILESCN(CCc1ccncc1)CCC(NC1CC1)C(N)=O
InChIInChI=1S/C15H24N4O/c1-19(10-6-12-4-8-17-9-5-12)11-7-14(15(16)20)18-13-2-3-13/h4-5,8-9,13-14,18H,2-3,6-7,10-11H2,1H3,(H2,16,20)
InChIKeyPFVNRKRYXCEGBT-UHFFFAOYSA-N
MW276.38 g/mol
LogP0.55
Rot. Bonds9

About 2-(cyclopropylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butanamide

2-(cyclopropylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butanamide (PubChem CID 63054235) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 2-(cyclopropylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butanamide.

Molecular Properties

Compound Name2-(cyclopropylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butanamide
PubChem CID63054235
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name2-(cyclopropylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butanamide
SMILESCN(CCc1ccncc1)CCC(NC1CC1)C(N)=O
InChIInChI=1S/C15H24N4O/c1-19(10-6-12-4-8-17-9-5-12)11-7-14(15(16)20)18-13-2-3-13/h4-5,8-9,13-14,18H,2-3,6-7,10-11H2,1H3,(H2,16,20)
InChIKeyPFVNRKRYXCEGBT-UHFFFAOYSA-N
XLogP0.55
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(cyclopropylamino)-4-[methyl(2,2,2-trifluoroethyl)amino]butanamide
CID 63055288
N-cyclopentyl-3-[methyl(2-pyridin-4-ylethyl)amino]propanamide
CID 109013454
2-(cyclopropylamino)-4-[2,2-dimethylpropyl(methyl)amino]butanamide
CID 63052904
N-cyclohexyl-2-[methyl(2-pyridin-4-ylethyl)amino]acetamide
CID 108993655
2-amino-4-[methyl(2-pyridin-4-ylethyl)amino]butan-1-ol
CID 64825859
1-(3-methylpiperidin-1-yl)-3-[methyl(2-pyridin-4-ylethyl)amino]propan-1-one
CID 109026177
hydrazinyl 3-[methyl(2-pyridin-4-ylethyl)amino]propanoate
CID 66339679
N',2-dimethyl-N'-(2-pyridin-4-ylethyl)butanediamide
CID 112510368
2-(cyclopropylamino)-4-[methyl-(2-methylcyclohexyl)amino]butanamide
CID 63053076
2-(cyclopropylamino)-4-(3-fluoro-N-methylanilino)butanamide
CID 63054343
3-methyl-2-[methyl(2-pyridin-4-ylethyl)amino]butanehydrazide
CID 55213835
N-(dicyclopropylmethyl)-N'-methyl-N'-(2-pyridin-4-ylethyl)ethane-1,2-diamine
CID 62560654

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butanamide?
The IUPAC name of 2-(cyclopropylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butanamide (CID 63054235) is 2-(cyclopropylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butanamide.
What is the SMILES notation for 2-(cyclopropylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butanamide?
The canonical SMILES for 2-(cyclopropylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butanamide is CN(CCc1ccncc1)CCC(NC1CC1)C(N)=O.
What is the InChIKey of 2-(cyclopropylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butanamide?
The InChIKey is PFVNRKRYXCEGBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-19(10-6-12-4-8-17-9-5-12)11-7-14(15(16)20)18-13-2-3-13/h4-5,8-9,13-14,18H,2-3,6-7,10-11H2,1H3,(H2,16,20).
What are the key properties of 2-(cyclopropylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butanamide?
2-(cyclopropylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butanamide has a molecular weight of 276.38 g/mol, XLogP of 0.55, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-4-[methyl(2-pyridin-4-ylethyl)amino]butanamide is sourced from PubChem (CID 63054235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).