N-(2-cycloheptyl-3-phenylpropyl)cyclopropanamine

C19H29N — CID 82932346

IUPACN-(2-cycloheptyl-3-phenylpropyl)cyclopropanamine
SMILESc1ccc(CC(CNC2CC2)C2CCCCCC2)cc1
InChIInChI=1S/C19H29N/c1-2-7-11-17(10-6-1)18(15-20-19-12-13-19)14-16-8-4-3-5-9-16/h3-5,8-9,17-20H,1-2,6-7,10-15H2
InChIKeyRBXIWVUTFFFFLW-UHFFFAOYSA-N
MW271.45 g/mol
LogP4.57
Rot. Bonds6

About N-(2-cycloheptyl-3-phenylpropyl)cyclopropanamine

N-(2-cycloheptyl-3-phenylpropyl)cyclopropanamine (PubChem CID 82932346) has the molecular formula C19H29N and a molecular weight of 271.45 g/mol. Its IUPAC name is N-(2-cycloheptyl-3-phenylpropyl)cyclopropanamine.

Molecular Properties

Compound NameN-(2-cycloheptyl-3-phenylpropyl)cyclopropanamine
PubChem CID82932346
Molecular FormulaC19H29N
Molecular Weight271.45 g/mol
Exact Mass271.23
IUPAC NameN-(2-cycloheptyl-3-phenylpropyl)cyclopropanamine
SMILESc1ccc(CC(CNC2CC2)C2CCCCCC2)cc1
InChIInChI=1S/C19H29N/c1-2-7-11-17(10-6-1)18(15-20-19-12-13-19)14-16-8-4-3-5-9-16/h3-5,8-9,17-20H,1-2,6-7,10-15H2
InChIKeyRBXIWVUTFFFFLW-UHFFFAOYSA-N
XLogP4.57
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 ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-cyclopropyl-3-phenylpropyl)cyclopropanamine
CID 104819239
N-[2-cyclohexyl-3-(4-methylphenyl)propyl]cyclopropanamine
CID 82934027
2-cyclohexyl-N-methyl-3-phenylpropan-1-amine
CID 82931379
N-[2-cycloheptyl-3-(3-methylphenyl)propyl]cyclopropanamine
CID 82933526
2-cyclohexyl-3-phenylpropan-1-ol
CID 82936977
N-[3-(4-bromophenyl)-2-cyclopropylpropyl]cyclopropanamine
CID 104819277
1-N-cyclohexyl-3-phenylpropane-1,2-diamine
CID 61149481
2-benzyl-3-(cyclopropylamino)propan-1-ol
CID 117241557
2-benzyl-N'-cyclopropylpropane-1,3-diamine
CID 117241556
(1-chloro-2-phenylethyl)cycloheptane
CID 63542336
2-cyclohexylpropylbenzene
CID 15846297
(1-cyclooctyl-2-phenylethyl)hydrazine
CID 105254972

Frequently Asked Questions

What is the IUPAC name of N-(2-cycloheptyl-3-phenylpropyl)cyclopropanamine?
The IUPAC name of N-(2-cycloheptyl-3-phenylpropyl)cyclopropanamine (CID 82932346) is N-(2-cycloheptyl-3-phenylpropyl)cyclopropanamine.
What is the SMILES notation for N-(2-cycloheptyl-3-phenylpropyl)cyclopropanamine?
The canonical SMILES for N-(2-cycloheptyl-3-phenylpropyl)cyclopropanamine is c1ccc(CC(CNC2CC2)C2CCCCCC2)cc1.
What is the InChIKey of N-(2-cycloheptyl-3-phenylpropyl)cyclopropanamine?
The InChIKey is RBXIWVUTFFFFLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N/c1-2-7-11-17(10-6-1)18(15-20-19-12-13-19)14-16-8-4-3-5-9-16/h3-5,8-9,17-20H,1-2,6-7,10-15H2.
What are the key properties of N-(2-cycloheptyl-3-phenylpropyl)cyclopropanamine?
N-(2-cycloheptyl-3-phenylpropyl)cyclopropanamine has a molecular weight of 271.45 g/mol, XLogP of 4.57, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cycloheptyl-3-phenylpropyl)cyclopropanamine is sourced from PubChem (CID 82932346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).