N-(3-aminopropyl)-N-cyclohexyl-2-methylbutanamide

C14H28N2O — CID 43136859

IUPACN-(3-aminopropyl)-N-cyclohexyl-2-methylbutanamide
SMILESCCC(C)C(=O)N(CCCN)C1CCCCC1
InChIInChI=1S/C14H28N2O/c1-3-12(2)14(17)16(11-7-10-15)13-8-5-4-6-9-13/h12-13H,3-11,15H2,1-2H3
InChIKeySGIPOGRYRIWVFF-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.54
Rot. Bonds6

About N-(3-aminopropyl)-N-cyclohexyl-2-methylbutanamide

N-(3-aminopropyl)-N-cyclohexyl-2-methylbutanamide (PubChem CID 43136859) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-(3-aminopropyl)-N-cyclohexyl-2-methylbutanamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-N-cyclohexyl-2-methylbutanamide
PubChem CID43136859
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-(3-aminopropyl)-N-cyclohexyl-2-methylbutanamide
SMILESCCC(C)C(=O)N(CCCN)C1CCCCC1
InChIInChI=1S/C14H28N2O/c1-3-12(2)14(17)16(11-7-10-15)13-8-5-4-6-9-13/h12-13H,3-11,15H2,1-2H3
InChIKeySGIPOGRYRIWVFF-UHFFFAOYSA-N
XLogP2.54
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(3-aminopropyl)-N-cyclohexyl-2-methylbutanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-Cyclohexylbutyramide
CID 221801
N-cyclohexyl-3-methylbutanamide
CID 233660
N-butyl-1-cyclohexyl-5-oxopyrrolidine-3-carboxamide
CID 3236135
1-butyl-N-cyclohexyl-5-oxopyrrolidine-3-carboxamide
CID 3245728
1-sec-butyl-N-cyclohexyl-5-oxopyrrolidine-3-carboxamide
CID 3239387
n-Cyclohexyl-2-methylpropanamide
CID 221976
2-methyl-N-[1-(propan-2-yl)piperidin-4-yl]propanamide
CID 25236583
2-methyl-N-(1-propylpiperidin-4-yl)propanamide
CID 25236862
1-(4-Aminopiperidin-1-yl)-2-methylpropan-1-one hydrochloride
CID 17221643
1-(4-Aminopiperidin-1-yl)-2-ethylbutan-1-one
CID 20117980
1-(3-Aminopiperidin-1-yl)-3-methylbutan-1-one
CID 25219402
3-Pyrrolidinecarboxamide, 1-cyclohexyl-N-(1-methylpropyl)-5-oxo-
CID 3401597

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-N-cyclohexyl-2-methylbutanamide?
The IUPAC name of N-(3-aminopropyl)-N-cyclohexyl-2-methylbutanamide (CID 43136859) is N-(3-aminopropyl)-N-cyclohexyl-2-methylbutanamide.
What is the SMILES notation for N-(3-aminopropyl)-N-cyclohexyl-2-methylbutanamide?
The canonical SMILES for N-(3-aminopropyl)-N-cyclohexyl-2-methylbutanamide is CCC(C)C(=O)N(CCCN)C1CCCCC1.
What is the InChIKey of N-(3-aminopropyl)-N-cyclohexyl-2-methylbutanamide?
The InChIKey is SGIPOGRYRIWVFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-3-12(2)14(17)16(11-7-10-15)13-8-5-4-6-9-13/h12-13H,3-11,15H2,1-2H3.
What are the key properties of N-(3-aminopropyl)-N-cyclohexyl-2-methylbutanamide?
N-(3-aminopropyl)-N-cyclohexyl-2-methylbutanamide has a molecular weight of 240.39 g/mol, XLogP of 2.54, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-N-cyclohexyl-2-methylbutanamide is sourced from PubChem (CID 43136859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).