N-[2-cyclohexyl-3-(4-methylphenyl)propyl]cyclopropanamine

C19H29N — CID 82934027

IUPACN-[2-cyclohexyl-3-(4-methylphenyl)propyl]cyclopropanamine
SMILESCc1ccc(CC(CNC2CC2)C2CCCCC2)cc1
InChIInChI=1S/C19H29N/c1-15-7-9-16(10-8-15)13-18(14-20-19-11-12-19)17-5-3-2-4-6-17/h7-10,17-20H,2-6,11-14H2,1H3
InChIKeyUIOZSLHYIJZWJX-UHFFFAOYSA-N
MW271.45 g/mol
LogP4.49
Rot. Bonds6

About N-[2-cyclohexyl-3-(4-methylphenyl)propyl]cyclopropanamine

N-[2-cyclohexyl-3-(4-methylphenyl)propyl]cyclopropanamine (PubChem CID 82934027) has the molecular formula C19H29N and a molecular weight of 271.45 g/mol. Its IUPAC name is N-[2-cyclohexyl-3-(4-methylphenyl)propyl]cyclopropanamine.

Molecular Properties

Compound NameN-[2-cyclohexyl-3-(4-methylphenyl)propyl]cyclopropanamine
PubChem CID82934027
Molecular FormulaC19H29N
Molecular Weight271.45 g/mol
Exact Mass271.23
IUPAC NameN-[2-cyclohexyl-3-(4-methylphenyl)propyl]cyclopropanamine
SMILESCc1ccc(CC(CNC2CC2)C2CCCCC2)cc1
InChIInChI=1S/C19H29N/c1-15-7-9-16(10-8-15)13-18(14-20-19-11-12-19)17-5-3-2-4-6-17/h7-10,17-20H,2-6,11-14H2,1H3
InChIKeyUIOZSLHYIJZWJX-UHFFFAOYSA-N
XLogP4.49
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.45
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-cycloheptyl-3-phenylpropyl)cyclopropanamine
CID 82932346
N-[2-cycloheptyl-3-(3-methylphenyl)propyl]cyclopropanamine
CID 82933526
[1-bromo-3-(4-methylphenyl)propan-2-yl]cycloheptane
CID 82946366
N-[3-(4-bromophenyl)-2-cyclopropylpropyl]cyclopropanamine
CID 104819277
N-(2-cyclopropyl-3-phenylpropyl)cyclopropanamine
CID 104819239
2-cyclohexyl-N-methyl-3-phenylpropan-1-amine
CID 82931379
N-[4-ethyl-2-[(4-methylphenyl)methyl]hexyl]cyclopropanamine
CID 82930839
1-cycloheptyl-N-ethyl-2-(4-methylphenyl)ethanamine
CID 63528977
N-[2-[(4-methylphenyl)methyl]hexyl]cyclopropanamine
CID 63523137
N-[2-[(4-methylphenyl)methyl]-4-propan-2-yloxybutyl]cyclopropanamine
CID 62514332
1-(3-bromo-2-cyclopropylpropyl)-4-methylbenzene
CID 104819629
[1-cyclopentyl-2-(4-methylphenyl)ethyl]hydrazine
CID 105204429

Frequently Asked Questions

What is the IUPAC name of N-[2-cyclohexyl-3-(4-methylphenyl)propyl]cyclopropanamine?
The IUPAC name of N-[2-cyclohexyl-3-(4-methylphenyl)propyl]cyclopropanamine (CID 82934027) is N-[2-cyclohexyl-3-(4-methylphenyl)propyl]cyclopropanamine.
What is the SMILES notation for N-[2-cyclohexyl-3-(4-methylphenyl)propyl]cyclopropanamine?
The canonical SMILES for N-[2-cyclohexyl-3-(4-methylphenyl)propyl]cyclopropanamine is Cc1ccc(CC(CNC2CC2)C2CCCCC2)cc1.
What is the InChIKey of N-[2-cyclohexyl-3-(4-methylphenyl)propyl]cyclopropanamine?
The InChIKey is UIOZSLHYIJZWJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N/c1-15-7-9-16(10-8-15)13-18(14-20-19-11-12-19)17-5-3-2-4-6-17/h7-10,17-20H,2-6,11-14H2,1H3.
What are the key properties of N-[2-cyclohexyl-3-(4-methylphenyl)propyl]cyclopropanamine?
N-[2-cyclohexyl-3-(4-methylphenyl)propyl]cyclopropanamine has a molecular weight of 271.45 g/mol, XLogP of 4.49, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-cyclohexyl-3-(4-methylphenyl)propyl]cyclopropanamine is sourced from PubChem (CID 82934027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).