3-[cyclobutylmethyl(methyl)amino]-2-cyclopropyl-2-(propylamino)propanamide

C15H29N3O — CID 63925000

IUPAC3-[cyclobutylmethyl(methyl)amino]-2-cyclopropyl-2-(propylamino)propanamide
SMILESCCCNC(CN(C)CC1CCC1)(C(N)=O)C1CC1
InChIInChI=1S/C15H29N3O/c1-3-9-17-15(14(16)19,13-7-8-13)11-18(2)10-12-5-4-6-12/h12-13,17H,3-11H2,1-2H3,(H2,16,19)
InChIKeyNLICHBFVXOAIMI-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.35
Rot. Bonds9

About 3-[cyclobutylmethyl(methyl)amino]-2-cyclopropyl-2-(propylamino)propanamide

3-[cyclobutylmethyl(methyl)amino]-2-cyclopropyl-2-(propylamino)propanamide (PubChem CID 63925000) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 3-[cyclobutylmethyl(methyl)amino]-2-cyclopropyl-2-(propylamino)propanamide.

Molecular Properties

Compound Name3-[cyclobutylmethyl(methyl)amino]-2-cyclopropyl-2-(propylamino)propanamide
PubChem CID63925000
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name3-[cyclobutylmethyl(methyl)amino]-2-cyclopropyl-2-(propylamino)propanamide
SMILESCCCNC(CN(C)CC1CCC1)(C(N)=O)C1CC1
InChIInChI=1S/C15H29N3O/c1-3-9-17-15(14(16)19,13-7-8-13)11-18(2)10-12-5-4-6-12/h12-13,17H,3-11H2,1-2H3,(H2,16,19)
InChIKeyNLICHBFVXOAIMI-UHFFFAOYSA-N
XLogP1.35
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopropyl-3-[methyl(oxan-2-ylmethyl)amino]-2-(propylamino)propanamide
CID 63911732
2-cyclopropyl-3-[2,2-dimethylpropyl(methyl)amino]-2-(propylamino)propanamide
CID 63909203
2-cyclopropyl-3-[methyl(propan-2-yl)amino]-2-(propylamino)propanamide
CID 63907693
3-[cyclohexylmethyl(methyl)amino]-2-cyclopropyl-2-(ethylamino)propanoic acid
CID 63916273
2-cyclopropyl-3-[ethyl(2-methylpropyl)amino]-2-(propylamino)propanamide
CID 63908718
2-cyclopropyl-3-[ethyl(2-ethylbutyl)amino]-2-(propylamino)propanamide
CID 63910757
ethyl 3-[cyclobutylmethyl(methyl)amino]-2-cyclopropyl-2-(cyclopropylamino)propanoate
CID 63927639
2-cyclopropyl-3-[cyclopropylmethyl(methyl)amino]-2-(propan-2-ylamino)propanoic acid
CID 63910337
2-cyclopropyl-3-[ethyl(2-methoxyethyl)amino]-2-(propylamino)propanamide
CID 63911750
2-cyclopropyl-2-(methylamino)-3-[methyl(propyl)amino]propanamide
CID 63906423
ethyl 2-cyclopropyl-3-[2,2-dimethylpropyl(methyl)amino]-2-(propylamino)propanoate
CID 63911759
3-[cyclohexylmethyl(methyl)amino]-2-methyl-2-(propylamino)propan-1-ol
CID 64826426

Frequently Asked Questions

What is the IUPAC name of 3-[cyclobutylmethyl(methyl)amino]-2-cyclopropyl-2-(propylamino)propanamide?
The IUPAC name of 3-[cyclobutylmethyl(methyl)amino]-2-cyclopropyl-2-(propylamino)propanamide (CID 63925000) is 3-[cyclobutylmethyl(methyl)amino]-2-cyclopropyl-2-(propylamino)propanamide.
What is the SMILES notation for 3-[cyclobutylmethyl(methyl)amino]-2-cyclopropyl-2-(propylamino)propanamide?
The canonical SMILES for 3-[cyclobutylmethyl(methyl)amino]-2-cyclopropyl-2-(propylamino)propanamide is CCCNC(CN(C)CC1CCC1)(C(N)=O)C1CC1.
What is the InChIKey of 3-[cyclobutylmethyl(methyl)amino]-2-cyclopropyl-2-(propylamino)propanamide?
The InChIKey is NLICHBFVXOAIMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-3-9-17-15(14(16)19,13-7-8-13)11-18(2)10-12-5-4-6-12/h12-13,17H,3-11H2,1-2H3,(H2,16,19).
What are the key properties of 3-[cyclobutylmethyl(methyl)amino]-2-cyclopropyl-2-(propylamino)propanamide?
3-[cyclobutylmethyl(methyl)amino]-2-cyclopropyl-2-(propylamino)propanamide has a molecular weight of 267.42 g/mol, XLogP of 1.35, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[cyclobutylmethyl(methyl)amino]-2-cyclopropyl-2-(propylamino)propanamide is sourced from PubChem (CID 63925000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).