4-[cyclopropyl(ethyl)amino]-2-(methylamino)butanamide

C10H21N3O — CID 63029394

IUPAC4-[cyclopropyl(ethyl)amino]-2-(methylamino)butanamide
SMILESCCN(CCC(NC)C(N)=O)C1CC1
InChIInChI=1S/C10H21N3O/c1-3-13(8-4-5-8)7-6-9(12-2)10(11)14/h8-9,12H,3-7H2,1-2H3,(H2,11,14)
InChIKeyZWUKUJJVRGLSIM-UHFFFAOYSA-N
MW199.30 g/mol
LogP-0.07
Rot. Bonds7

About 4-[cyclopropyl(ethyl)amino]-2-(methylamino)butanamide

4-[cyclopropyl(ethyl)amino]-2-(methylamino)butanamide (PubChem CID 63029394) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is 4-[cyclopropyl(ethyl)amino]-2-(methylamino)butanamide.

Molecular Properties

Compound Name4-[cyclopropyl(ethyl)amino]-2-(methylamino)butanamide
PubChem CID63029394
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC Name4-[cyclopropyl(ethyl)amino]-2-(methylamino)butanamide
SMILESCCN(CCC(NC)C(N)=O)C1CC1
InChIInChI=1S/C10H21N3O/c1-3-13(8-4-5-8)7-6-9(12-2)10(11)14/h8-9,12H,3-7H2,1-2H3,(H2,11,14)
InChIKeyZWUKUJJVRGLSIM-UHFFFAOYSA-N
XLogP-0.07
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[cyclopropyl(ethyl)amino]-2-(methylamino)butanoic acid
CID 63027479
methyl 4-[cyclopropyl(3-methylbutyl)amino]-2-(methylamino)butanoate
CID 78923975
4-[cyclobutylmethyl(methyl)amino]-2-(methylamino)butanamide
CID 63055054
methyl 4-[cyclopropyl(2-methoxyethyl)amino]-2-(methylamino)butanoate
CID 55145669
4-[cyclopropyl(cyclopropylmethyl)amino]-2-(propylamino)butanamide
CID 64521638
2,5-bis(methylamino)hexanediamide
CID 66221520
4-[cyclopropyl(cyclopropylmethyl)amino]-2-(propan-2-ylamino)butanamide
CID 64521837
4-[ethyl(2-methylpropyl)amino]-2-(methylamino)butanamide
CID 63028616
3-[(4-aminocyclohexyl)-ethylamino]propanoic acid
CID 79115702
1-N-cyclopropyl-1-N-ethyl-3-N,4,4-trimethylpentane-1,3-diamine
CID 62624071
4-[cyclopropyl(methyl)amino]-2-(ethylamino)butanamide
CID 63027258
4-[cyclopropyl(ethyl)amino]-2-ethoxybutanoic acid
CID 63069124

Frequently Asked Questions

What is the IUPAC name of 4-[cyclopropyl(ethyl)amino]-2-(methylamino)butanamide?
The IUPAC name of 4-[cyclopropyl(ethyl)amino]-2-(methylamino)butanamide (CID 63029394) is 4-[cyclopropyl(ethyl)amino]-2-(methylamino)butanamide.
What is the SMILES notation for 4-[cyclopropyl(ethyl)amino]-2-(methylamino)butanamide?
The canonical SMILES for 4-[cyclopropyl(ethyl)amino]-2-(methylamino)butanamide is CCN(CCC(NC)C(N)=O)C1CC1.
What is the InChIKey of 4-[cyclopropyl(ethyl)amino]-2-(methylamino)butanamide?
The InChIKey is ZWUKUJJVRGLSIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O/c1-3-13(8-4-5-8)7-6-9(12-2)10(11)14/h8-9,12H,3-7H2,1-2H3,(H2,11,14).
What are the key properties of 4-[cyclopropyl(ethyl)amino]-2-(methylamino)butanamide?
4-[cyclopropyl(ethyl)amino]-2-(methylamino)butanamide has a molecular weight of 199.30 g/mol, XLogP of -0.07, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[cyclopropyl(ethyl)amino]-2-(methylamino)butanamide is sourced from PubChem (CID 63029394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).