4-amino-N-cyclopropyl-3-[cyclopropyl(2-methylpropyl)amino]butanamide

C14H27N3O — CID 66430186

IUPAC4-amino-N-cyclopropyl-3-[cyclopropyl(2-methylpropyl)amino]butanamide
SMILESCC(C)CN(C1CC1)C(CN)CC(=O)NC1CC1
InChIInChI=1S/C14H27N3O/c1-10(2)9-17(12-5-6-12)13(8-15)7-14(18)16-11-3-4-11/h10-13H,3-9,15H2,1-2H3,(H,16,18)
InChIKeyOUDGUKYDBCBBTO-UHFFFAOYSA-N
MW253.39 g/mol
LogP1.10
Rot. Bonds8

About 4-amino-N-cyclopropyl-3-[cyclopropyl(2-methylpropyl)amino]butanamide

4-amino-N-cyclopropyl-3-[cyclopropyl(2-methylpropyl)amino]butanamide (PubChem CID 66430186) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is 4-amino-N-cyclopropyl-3-[cyclopropyl(2-methylpropyl)amino]butanamide.

Molecular Properties

Compound Name4-amino-N-cyclopropyl-3-[cyclopropyl(2-methylpropyl)amino]butanamide
PubChem CID66430186
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC Name4-amino-N-cyclopropyl-3-[cyclopropyl(2-methylpropyl)amino]butanamide
SMILESCC(C)CN(C1CC1)C(CN)CC(=O)NC1CC1
InChIInChI=1S/C14H27N3O/c1-10(2)9-17(12-5-6-12)13(8-15)7-14(18)16-11-3-4-11/h10-13H,3-9,15H2,1-2H3,(H,16,18)
InChIKeyOUDGUKYDBCBBTO-UHFFFAOYSA-N
XLogP1.10
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-cyclopropyl-3-[methyl(3-methylbutyl)amino]butanamide
CID 66430996
4-amino-N-cyclopropyl-3-[ethyl(2-methylbutyl)amino]butanamide
CID 79478006
4-amino-N-cyclopropyl-3-[methyl(2-propan-2-yloxyethyl)amino]butanamide
CID 81058816
4-amino-N-cyclopropyl-3-[cyclopropylmethyl(ethyl)amino]butanamide
CID 66432647
4-amino-N-cyclopropyl-3-[methyl(oxolan-3-yl)amino]butanamide
CID 82735649
4-amino-3-[cyclopropyl(3-methylbutyl)amino]-N,N-dimethylbutanamide
CID 79036633
4-amino-3-[cyclopropyl(propyl)amino]-N-propylbutanamide
CID 66426544
4-amino-N-cyclobutyl-3-methylbutanamide
CID 81086885
4-amino-N-cyclohexyl-3-methylbutanamide
CID 81070976
4-amino-N-cyclopropyl-3-[methyl(oxan-3-ylmethyl)amino]butanamide
CID 66432240
3-amino-N-(4-methylcyclohexyl)butanamide
CID 60835833
ethyl 2-[cyclopropyl(2-methylpropyl)amino]butanoate
CID 64661063

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-cyclopropyl-3-[cyclopropyl(2-methylpropyl)amino]butanamide?
The IUPAC name of 4-amino-N-cyclopropyl-3-[cyclopropyl(2-methylpropyl)amino]butanamide (CID 66430186) is 4-amino-N-cyclopropyl-3-[cyclopropyl(2-methylpropyl)amino]butanamide.
What is the SMILES notation for 4-amino-N-cyclopropyl-3-[cyclopropyl(2-methylpropyl)amino]butanamide?
The canonical SMILES for 4-amino-N-cyclopropyl-3-[cyclopropyl(2-methylpropyl)amino]butanamide is CC(C)CN(C1CC1)C(CN)CC(=O)NC1CC1.
What is the InChIKey of 4-amino-N-cyclopropyl-3-[cyclopropyl(2-methylpropyl)amino]butanamide?
The InChIKey is OUDGUKYDBCBBTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c1-10(2)9-17(12-5-6-12)13(8-15)7-14(18)16-11-3-4-11/h10-13H,3-9,15H2,1-2H3,(H,16,18).
What are the key properties of 4-amino-N-cyclopropyl-3-[cyclopropyl(2-methylpropyl)amino]butanamide?
4-amino-N-cyclopropyl-3-[cyclopropyl(2-methylpropyl)amino]butanamide has a molecular weight of 253.39 g/mol, XLogP of 1.10, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-cyclopropyl-3-[cyclopropyl(2-methylpropyl)amino]butanamide is sourced from PubChem (CID 66430186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).