N-[(2-methylcyclopentyl)methyl]-2-propan-2-yloxan-4-amine

C15H29NO — CID 107417410

IUPACN-[(2-methylcyclopentyl)methyl]-2-propan-2-yloxan-4-amine
SMILESCC(C)C1CC(NCC2CCCC2C)CCO1
InChIInChI=1S/C15H29NO/c1-11(2)15-9-14(7-8-17-15)16-10-13-6-4-5-12(13)3/h11-16H,4-10H2,1-3H3
InChIKeyOINOBYPVEPEQEU-UHFFFAOYSA-N
MW239.40 g/mol
LogP3.22
Rot. Bonds4

About N-[(2-methylcyclopentyl)methyl]-2-propan-2-yloxan-4-amine

N-[(2-methylcyclopentyl)methyl]-2-propan-2-yloxan-4-amine (PubChem CID 107417410) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is N-[(2-methylcyclopentyl)methyl]-2-propan-2-yloxan-4-amine.

Molecular Properties

Compound NameN-[(2-methylcyclopentyl)methyl]-2-propan-2-yloxan-4-amine
PubChem CID107417410
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC NameN-[(2-methylcyclopentyl)methyl]-2-propan-2-yloxan-4-amine
SMILESCC(C)C1CC(NCC2CCCC2C)CCO1
InChIInChI=1S/C15H29NO/c1-11(2)15-9-14(7-8-17-15)16-10-13-6-4-5-12(13)3/h11-16H,4-10H2,1-3H3
InChIKeyOINOBYPVEPEQEU-UHFFFAOYSA-N
XLogP3.22
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[(2-methylcyclopentyl)methyl]-2-propan-2-yloxan-4-amine 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

2-propan-2-yl-N-(3,3,3-trifluoropropyl)oxan-4-amine
CID 64102696
2-propan-2-yl-N-(2,2,2-trifluoroethyl)oxan-4-amine
CID 64106491
2-cyclopentyl-N-propan-2-yl-3-(2,2,2-trifluoroethoxy)propan-1-amine
CID 106706209
2-propan-2-yl-N-(4,4,4-trifluorobutan-2-yl)oxan-4-amine
CID 113348149
N-(2,2-difluoroethyl)-2-propan-2-yloxan-4-amine
CID 115406058
2-propan-2-yl-N-(4,4,4-trifluorobutyl)oxan-4-amine
CID 115516555
2-propan-2-yl-N-(5,5,5-trifluoropentyl)oxan-4-amine
CID 115517490
2,2,6-Trimethyl-4-(8-methyloctadecoxy)piperidine
CID 17902157
N,2,3,6-tetramethyloxan-4-amine
CID 59892957
N-[(1R,3R)-3-propan-2-ylcyclopentyl]oxan-4-amine
CID 71069537
(4S)-3-tert-butyl-N-cyclopentyloxan-4-amine
CID 90290945
2-Ethyl-2-(oxolan-2-ylmethyl)piperidine
CID 117271258

Frequently Asked Questions

What is the IUPAC name of N-[(2-methylcyclopentyl)methyl]-2-propan-2-yloxan-4-amine?
The IUPAC name of N-[(2-methylcyclopentyl)methyl]-2-propan-2-yloxan-4-amine (CID 107417410) is N-[(2-methylcyclopentyl)methyl]-2-propan-2-yloxan-4-amine.
What is the SMILES notation for N-[(2-methylcyclopentyl)methyl]-2-propan-2-yloxan-4-amine?
The canonical SMILES for N-[(2-methylcyclopentyl)methyl]-2-propan-2-yloxan-4-amine is CC(C)C1CC(NCC2CCCC2C)CCO1.
What is the InChIKey of N-[(2-methylcyclopentyl)methyl]-2-propan-2-yloxan-4-amine?
The InChIKey is OINOBYPVEPEQEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO/c1-11(2)15-9-14(7-8-17-15)16-10-13-6-4-5-12(13)3/h11-16H,4-10H2,1-3H3.
What are the key properties of N-[(2-methylcyclopentyl)methyl]-2-propan-2-yloxan-4-amine?
N-[(2-methylcyclopentyl)methyl]-2-propan-2-yloxan-4-amine has a molecular weight of 239.40 g/mol, XLogP of 3.22, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylcyclopentyl)methyl]-2-propan-2-yloxan-4-amine is sourced from PubChem (CID 107417410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).