N-(cyclopentylmethyl)-4-methoxy-4-methylpentan-2-amine

C13H27NO — CID 43370737

IUPACN-(cyclopentylmethyl)-4-methoxy-4-methylpentan-2-amine
SMILESCOC(C)(C)CC(C)NCC1CCCC1
InChIInChI=1S/C13H27NO/c1-11(9-13(2,3)15-4)14-10-12-7-5-6-8-12/h11-12,14H,5-10H2,1-4H3
InChIKeyCVHPRRARPSUCAR-UHFFFAOYSA-N
MW213.36 g/mol
LogP2.97
Rot. Bonds6

About N-(cyclopentylmethyl)-4-methoxy-4-methylpentan-2-amine

N-(cyclopentylmethyl)-4-methoxy-4-methylpentan-2-amine (PubChem CID 43370737) has the molecular formula C13H27NO and a molecular weight of 213.36 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-4-methoxy-4-methylpentan-2-amine.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-4-methoxy-4-methylpentan-2-amine
PubChem CID43370737
Molecular FormulaC13H27NO
Molecular Weight213.36 g/mol
Exact Mass213.21
IUPAC NameN-(cyclopentylmethyl)-4-methoxy-4-methylpentan-2-amine
SMILESCOC(C)(C)CC(C)NCC1CCCC1
InChIInChI=1S/C13H27NO/c1-11(9-13(2,3)15-4)14-10-12-7-5-6-8-12/h11-12,14H,5-10H2,1-4H3
InChIKeyCVHPRRARPSUCAR-UHFFFAOYSA-N
XLogP2.97
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.36
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(cyclopentylmethyl)-4-methoxy-4-methylpentan-2-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

4-methoxy-4-methyl-N-(thian-4-ylmethyl)pentan-2-amine
CID 115719916
3-[[(4-methoxy-4-methylpentan-2-yl)amino]methyl]cyclopentan-1-ol
CID 103271409
tert-butyl 3-[[(4-methoxy-4-methylpentan-2-yl)amino]methyl]piperidine-1-carboxylate
CID 103700546
tert-butyl 4-[[(4-methoxy-4-methylpentan-2-yl)amino]methyl]piperidine-1-carboxylate
CID 103766005
N-(cyclohexylmethyl)-2-methoxy-2-methylpropan-1-amine
CID 115757000
N-[(2R)-4-methoxy-4-methylpentan-2-yl]cyclopropanamine
CID 29013814
(3R)-3-(cyclopentylmethylamino)butan-1-ol
CID 103923917
methyl 3-(cyclopentylmethylamino)butanoate
CID 43536965
[(2R)-4-methoxy-4-methylpentan-2-yl]hydrazine
CID 29014952
4-methoxy-N-(2-methoxy-2-methylpropyl)-4-methylpentan-2-amine
CID 115728657
(2R)-N-(cyclobutylmethyl)-3,3-dimethylbutan-2-amine
CID 95732956
[2-[(4-methoxy-4-methylpentan-2-yl)amino]cyclohexyl]methanol
CID 103784997

Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-4-methoxy-4-methylpentan-2-amine?
The IUPAC name of N-(cyclopentylmethyl)-4-methoxy-4-methylpentan-2-amine (CID 43370737) is N-(cyclopentylmethyl)-4-methoxy-4-methylpentan-2-amine.
What is the SMILES notation for N-(cyclopentylmethyl)-4-methoxy-4-methylpentan-2-amine?
The canonical SMILES for N-(cyclopentylmethyl)-4-methoxy-4-methylpentan-2-amine is COC(C)(C)CC(C)NCC1CCCC1.
What is the InChIKey of N-(cyclopentylmethyl)-4-methoxy-4-methylpentan-2-amine?
The InChIKey is CVHPRRARPSUCAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO/c1-11(9-13(2,3)15-4)14-10-12-7-5-6-8-12/h11-12,14H,5-10H2,1-4H3.
What are the key properties of N-(cyclopentylmethyl)-4-methoxy-4-methylpentan-2-amine?
N-(cyclopentylmethyl)-4-methoxy-4-methylpentan-2-amine has a molecular weight of 213.36 g/mol, XLogP of 2.97, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-4-methoxy-4-methylpentan-2-amine is sourced from PubChem (CID 43370737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).