4-amino-N-cyclopropyl-3-[methyl(pyridin-2-ylmethyl)amino]butanamide

C14H22N4O — CID 66431406

IUPAC4-amino-N-cyclopropyl-3-[methyl(pyridin-2-ylmethyl)amino]butanamide
SMILESCN(Cc1ccccn1)C(CN)CC(=O)NC1CC1
InChIInChI=1S/C14H22N4O/c1-18(10-12-4-2-3-7-16-12)13(9-15)8-14(19)17-11-5-6-11/h2-4,7,11,13H,5-6,8-10,15H2,1H3,(H,17,19)
InChIKeyNLYNABZDRKDYJP-UHFFFAOYSA-N
MW262.36 g/mol
LogP0.51
Rot. Bonds7

About 4-amino-N-cyclopropyl-3-[methyl(pyridin-2-ylmethyl)amino]butanamide

4-amino-N-cyclopropyl-3-[methyl(pyridin-2-ylmethyl)amino]butanamide (PubChem CID 66431406) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 4-amino-N-cyclopropyl-3-[methyl(pyridin-2-ylmethyl)amino]butanamide.

Molecular Properties

Compound Name4-amino-N-cyclopropyl-3-[methyl(pyridin-2-ylmethyl)amino]butanamide
PubChem CID66431406
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name4-amino-N-cyclopropyl-3-[methyl(pyridin-2-ylmethyl)amino]butanamide
SMILESCN(Cc1ccccn1)C(CN)CC(=O)NC1CC1
InChIInChI=1S/C14H22N4O/c1-18(10-12-4-2-3-7-16-12)13(9-15)8-14(19)17-11-5-6-11/h2-4,7,11,13H,5-6,8-10,15H2,1H3,(H,17,19)
InChIKeyNLYNABZDRKDYJP-UHFFFAOYSA-N
XLogP0.51
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-3-[methyl(pyridin-2-ylmethyl)amino]-N-propan-2-ylbutanamide
CID 66430158
4-amino-3-[methyl(pyridin-2-ylmethyl)amino]butanamide
CID 66427540
4-amino-N-cyclopropyl-3-[methyl(1,3-thiazol-4-ylmethyl)amino]butanamide
CID 66431207
N-[(1R,3R)-3-aminocyclopentyl]-2-[methyl(pyridin-2-ylmethyl)amino]acetamide
CID 56868905
2-[acetyl(pyridin-2-ylmethyl)amino]-N-cycloheptylacetamide
CID 113163426
3-(4-ethylcyclohexyl)-1-methyl-1-(pyridin-2-ylmethyl)urea
CID 86841972
3-[acetyl(pyridin-2-ylmethyl)amino]-N-cycloheptylpropanamide
CID 113120220
N-cyclopropyl-2-[4-[1-[[methyl(pyridin-2-ylmethyl)carbamoyl]amino]ethyl]phenoxy]acetamide
CID 86841872
N-[4-(2,2-dimethylpropyl)cyclohexyl]-2-pyridin-2-ylacetamide
CID 164971686
3-amino-N-cyclopropyl-2-methyl-N-(pyridin-2-ylmethyl)propanamide
CID 62670174
4-[methyl(pyridin-2-ylmethyl)amino]pentanehydrazide
CID 63572365
N-cyclopentyl-3-pyridin-2-ylpropanamide
CID 78980134

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-cyclopropyl-3-[methyl(pyridin-2-ylmethyl)amino]butanamide?
The IUPAC name of 4-amino-N-cyclopropyl-3-[methyl(pyridin-2-ylmethyl)amino]butanamide (CID 66431406) is 4-amino-N-cyclopropyl-3-[methyl(pyridin-2-ylmethyl)amino]butanamide.
What is the SMILES notation for 4-amino-N-cyclopropyl-3-[methyl(pyridin-2-ylmethyl)amino]butanamide?
The canonical SMILES for 4-amino-N-cyclopropyl-3-[methyl(pyridin-2-ylmethyl)amino]butanamide is CN(Cc1ccccn1)C(CN)CC(=O)NC1CC1.
What is the InChIKey of 4-amino-N-cyclopropyl-3-[methyl(pyridin-2-ylmethyl)amino]butanamide?
The InChIKey is NLYNABZDRKDYJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-18(10-12-4-2-3-7-16-12)13(9-15)8-14(19)17-11-5-6-11/h2-4,7,11,13H,5-6,8-10,15H2,1H3,(H,17,19).
What are the key properties of 4-amino-N-cyclopropyl-3-[methyl(pyridin-2-ylmethyl)amino]butanamide?
4-amino-N-cyclopropyl-3-[methyl(pyridin-2-ylmethyl)amino]butanamide has a molecular weight of 262.36 g/mol, XLogP of 0.51, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-cyclopropyl-3-[methyl(pyridin-2-ylmethyl)amino]butanamide is sourced from PubChem (CID 66431406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).