N-[(1-benzylcyclopropyl)methyl]cyclopropanamine

C14H19N — CID 66026239

IUPACN-[(1-benzylcyclopropyl)methyl]cyclopropanamine
SMILESc1ccc(CC2(CNC3CC3)CC2)cc1
InChIInChI=1S/C14H19N/c1-2-4-12(5-3-1)10-14(8-9-14)11-15-13-6-7-13/h1-5,13,15H,6-11H2
InChIKeySULSOPUCAYXZGG-UHFFFAOYSA-N
MW201.31 g/mol
LogP2.76
Rot. Bonds5

About N-[(1-benzylcyclopropyl)methyl]cyclopropanamine

N-[(1-benzylcyclopropyl)methyl]cyclopropanamine (PubChem CID 66026239) has the molecular formula C14H19N and a molecular weight of 201.31 g/mol. Its IUPAC name is N-[(1-benzylcyclopropyl)methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[(1-benzylcyclopropyl)methyl]cyclopropanamine
PubChem CID66026239
Molecular FormulaC14H19N
Molecular Weight201.31 g/mol
Exact Mass201.15
IUPAC NameN-[(1-benzylcyclopropyl)methyl]cyclopropanamine
SMILESc1ccc(CC2(CNC3CC3)CC2)cc1
InChIInChI=1S/C14H19N/c1-2-4-12(5-3-1)10-14(8-9-14)11-15-13-6-7-13/h1-5,13,15H,6-11H2
InChIKeySULSOPUCAYXZGG-UHFFFAOYSA-N
XLogP2.76
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(1-benzyl-4-butylcyclohexyl)methyl]cyclopropanamine
CID 63521307
N-[[1-(furan-2-ylmethyl)cyclopropyl]methyl]cyclopropanamine
CID 66024468
1-benzyl-N-[(1-ethylcyclopropyl)methyl]piperidin-4-amine
CID 103735414
N-[[4-[(4-fluorophenyl)methyl]oxan-4-yl]methyl]cyclopropanamine
CID 62906105
N-[[1-(1-benzothiophen-3-ylmethyl)cyclopropyl]methyl]cyclopropanamine
CID 66024029
N-[[1-[(2-chlorophenyl)methyl]cyclopentyl]methyl]cyclopropanamine
CID 62723797
N-[[1-[[3-(trifluoromethyl)phenyl]methyl]cyclopentyl]methyl]cyclopropanamine
CID 62723191
N-ethylcyclopropanamine;phenylmethanamine
CID 143821485
N-[[4-[(2-methylphenyl)methyl]oxan-4-yl]methyl]cyclopropanamine
CID 62906269
N-[[1-[(3,4-difluorophenyl)methyl]cyclohexyl]methyl]cyclopropanamine
CID 82930846
N-[[1-[(2,4-dichlorophenyl)methyl]cyclopropyl]methyl]cyclopropanamine
CID 66026019
N-[[4-[(3-methoxyphenyl)methyl]oxan-4-yl]methyl]cyclopropanamine
CID 62905211

Frequently Asked Questions

What is the IUPAC name of N-[(1-benzylcyclopropyl)methyl]cyclopropanamine?
The IUPAC name of N-[(1-benzylcyclopropyl)methyl]cyclopropanamine (CID 66026239) is N-[(1-benzylcyclopropyl)methyl]cyclopropanamine.
What is the SMILES notation for N-[(1-benzylcyclopropyl)methyl]cyclopropanamine?
The canonical SMILES for N-[(1-benzylcyclopropyl)methyl]cyclopropanamine is c1ccc(CC2(CNC3CC3)CC2)cc1.
What is the InChIKey of N-[(1-benzylcyclopropyl)methyl]cyclopropanamine?
The InChIKey is SULSOPUCAYXZGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N/c1-2-4-12(5-3-1)10-14(8-9-14)11-15-13-6-7-13/h1-5,13,15H,6-11H2.
What are the key properties of N-[(1-benzylcyclopropyl)methyl]cyclopropanamine?
N-[(1-benzylcyclopropyl)methyl]cyclopropanamine has a molecular weight of 201.31 g/mol, XLogP of 2.76, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-benzylcyclopropyl)methyl]cyclopropanamine is sourced from PubChem (CID 66026239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).