N-methyl-5-phenyl-N-(1-phenylpropan-2-yl)pentan-1-amine

C21H29N — CID 14831238

IUPACN-methyl-5-phenyl-N-(1-phenylpropan-2-yl)pentan-1-amine
SMILESCC(Cc1ccccc1)N(C)CCCCCc1ccccc1
InChIInChI=1S/C21H29N/c1-19(18-21-15-8-4-9-16-21)22(2)17-11-5-10-14-20-12-6-3-7-13-20/h3-4,6-9,12-13,15-16,19H,5,10-11,14,17-18H2,1-2H3
InChIKeyNXFNRAVCNJHYJE-UHFFFAOYSA-N
MW295.47 g/mol
LogP4.96
Rot. Bonds9

About N-methyl-5-phenyl-N-(1-phenylpropan-2-yl)pentan-1-amine

N-methyl-5-phenyl-N-(1-phenylpropan-2-yl)pentan-1-amine (PubChem CID 14831238) has the molecular formula C21H29N and a molecular weight of 295.47 g/mol. Its IUPAC name is N-methyl-5-phenyl-N-(1-phenylpropan-2-yl)pentan-1-amine.

Molecular Properties

Compound NameN-methyl-5-phenyl-N-(1-phenylpropan-2-yl)pentan-1-amine
PubChem CID14831238
Molecular FormulaC21H29N
Molecular Weight295.47 g/mol
Exact Mass295.23
IUPAC NameN-methyl-5-phenyl-N-(1-phenylpropan-2-yl)pentan-1-amine
SMILESCC(Cc1ccccc1)N(C)CCCCCc1ccccc1
InChIInChI=1S/C21H29N/c1-19(18-21-15-8-4-9-16-21)22(2)17-11-5-10-14-20-12-6-3-7-13-20/h3-4,6-9,12-13,15-16,19H,5,10-11,14,17-18H2,1-2H3
InChIKeyNXFNRAVCNJHYJE-UHFFFAOYSA-N
XLogP4.96
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.47
LogP ≤ 54.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-methyl-5-phenyl-N-(1-phenylpropan-2-yl)pentan-1-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-methyl-1-phenyl-N-(3-phenylpropyl)propan-2-amine;hydrochloride
CID 158918700
N-(3-chloropropyl)-N-methyl-1-phenylpropan-2-amine
CID 110174057
N,N-dimethyl-7-phenylheptan-1-amine;hydrate
CID 173447731
N,N-dimethyl-18-phenyloctadecan-1-amine;hydrochloride
CID 173450545
N,N-dimethyl-9-phenylnonan-1-amine;hydrochloride
CID 173027256
N-benzyl-N-methyl-1-phenylpropan-2-amine
CID 2341
1-[methyl(3-phenylpropyl)amino]ethanol
CID 67730739
(2R)-N-bromo-N-methyl-1-phenylpropan-2-amine
CID 87517815
1-N,4-dimethyl-1-N-(1-phenylpropan-2-yl)pentane-1,3-diamine
CID 113285453
6-phenyl-N,N-bis(6-phenylhexyl)hexan-1-amine
CID 21451220
N,N-diethyl-17-phenylheptadecan-1-amine;hydrochloride
CID 173450606
N,N-dihexyl-12-phenyldodecan-1-amine
CID 158185325

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-phenyl-N-(1-phenylpropan-2-yl)pentan-1-amine?
The IUPAC name of N-methyl-5-phenyl-N-(1-phenylpropan-2-yl)pentan-1-amine (CID 14831238) is N-methyl-5-phenyl-N-(1-phenylpropan-2-yl)pentan-1-amine.
What is the SMILES notation for N-methyl-5-phenyl-N-(1-phenylpropan-2-yl)pentan-1-amine?
The canonical SMILES for N-methyl-5-phenyl-N-(1-phenylpropan-2-yl)pentan-1-amine is CC(Cc1ccccc1)N(C)CCCCCc1ccccc1.
What is the InChIKey of N-methyl-5-phenyl-N-(1-phenylpropan-2-yl)pentan-1-amine?
The InChIKey is NXFNRAVCNJHYJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H29N/c1-19(18-21-15-8-4-9-16-21)22(2)17-11-5-10-14-20-12-6-3-7-13-20/h3-4,6-9,12-13,15-16,19H,5,10-11,14,17-18H2,1-2H3.
What are the key properties of N-methyl-5-phenyl-N-(1-phenylpropan-2-yl)pentan-1-amine?
N-methyl-5-phenyl-N-(1-phenylpropan-2-yl)pentan-1-amine has a molecular weight of 295.47 g/mol, XLogP of 4.96, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-phenyl-N-(1-phenylpropan-2-yl)pentan-1-amine is sourced from PubChem (CID 14831238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).