N-[(1-benzylcyclobutyl)methyl]-2-methylpropan-2-amine

C16H25N — CID 65194402

IUPACN-[(1-benzylcyclobutyl)methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCC1(Cc2ccccc2)CCC1
InChIInChI=1S/C16H25N/c1-15(2,3)17-13-16(10-7-11-16)12-14-8-5-4-6-9-14/h4-6,8-9,17H,7,10-13H2,1-3H3
InChIKeyAFUNUHUSGOJQJA-UHFFFAOYSA-N
MW231.38 g/mol
LogP3.79
Rot. Bonds4

About N-[(1-benzylcyclobutyl)methyl]-2-methylpropan-2-amine

N-[(1-benzylcyclobutyl)methyl]-2-methylpropan-2-amine (PubChem CID 65194402) has the molecular formula C16H25N and a molecular weight of 231.38 g/mol. Its IUPAC name is N-[(1-benzylcyclobutyl)methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[(1-benzylcyclobutyl)methyl]-2-methylpropan-2-amine
PubChem CID65194402
Molecular FormulaC16H25N
Molecular Weight231.38 g/mol
Exact Mass231.20
IUPAC NameN-[(1-benzylcyclobutyl)methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCC1(Cc2ccccc2)CCC1
InChIInChI=1S/C16H25N/c1-15(2,3)17-13-16(10-7-11-16)12-14-8-5-4-6-9-14/h4-6,8-9,17H,7,10-13H2,1-3H3
InChIKeyAFUNUHUSGOJQJA-UHFFFAOYSA-N
XLogP3.79
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.38
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-[(1-benzylcyclobutyl)methyl]-2-methylpropan-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

N-[(3-benzyloxolan-3-yl)methyl]-2-methylpropan-2-amine
CID 62719389
N-[[1-[(3-methoxyphenyl)methyl]cyclobutyl]methyl]-2-methylpropan-2-amine
CID 65194679
N-[[1-[(3-bromophenyl)methyl]cyclohexyl]methyl]-2-methylpropan-2-amine
CID 63507661
2-methyl-N-[[1-[(4-methylphenyl)methyl]cyclopropyl]methyl]propan-2-amine
CID 66026023
2-methyl-N-[[1-(phenylmethoxymethyl)cyclopentyl]methyl]propan-2-amine
CID 102940491
N-[[1-[[benzyl(methyl)amino]methyl]cyclopentyl]methyl]-2-methylpropan-2-amine
CID 62262841
2-methyl-N-[[1-[(2-methylphenyl)methyl]cyclopentyl]methyl]propan-2-amine
CID 63509068
2-methyl-N-[[1-(thiophen-2-ylmethyl)cyclobutyl]methyl]propan-2-amine
CID 65194455
N-[[1-[(3-fluorophenyl)methyl]cyclopropyl]methyl]-2-methylpropan-2-amine
CID 66026247
N-[[1-(furan-2-ylmethyl)cyclobutyl]methyl]-2-methylpropan-2-amine
CID 65194561
2-methyl-N-[[1-(2-phenoxyethyl)cyclopentyl]methyl]propan-2-amine
CID 62725403
N-[[1-[(5-bromo-3-pyridinyl)methyl]cyclobutyl]methyl]-2-methylpropan-2-amine
CID 104810728

Frequently Asked Questions

What is the IUPAC name of N-[(1-benzylcyclobutyl)methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[(1-benzylcyclobutyl)methyl]-2-methylpropan-2-amine (CID 65194402) is N-[(1-benzylcyclobutyl)methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[(1-benzylcyclobutyl)methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[(1-benzylcyclobutyl)methyl]-2-methylpropan-2-amine is CC(C)(C)NCC1(Cc2ccccc2)CCC1.
What is the InChIKey of N-[(1-benzylcyclobutyl)methyl]-2-methylpropan-2-amine?
The InChIKey is AFUNUHUSGOJQJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N/c1-15(2,3)17-13-16(10-7-11-16)12-14-8-5-4-6-9-14/h4-6,8-9,17H,7,10-13H2,1-3H3.
What are the key properties of N-[(1-benzylcyclobutyl)methyl]-2-methylpropan-2-amine?
N-[(1-benzylcyclobutyl)methyl]-2-methylpropan-2-amine has a molecular weight of 231.38 g/mol, XLogP of 3.79, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-benzylcyclobutyl)methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 65194402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).