N-[(1-aminocyclopropyl)methyl]aniline

C10H14N2 — CID 65460018

IUPACN-[(1-aminocyclopropyl)methyl]aniline
SMILESNC1(CNc2ccccc2)CC1
InChIInChI=1S/C10H14N2/c11-10(6-7-10)8-12-9-4-2-1-3-5-9/h1-5,12H,6-8,11H2
InChIKeyWCGFKFSJIIYPCA-UHFFFAOYSA-N
MW162.24 g/mol
LogP1.59
Rot. Bonds3

About N-[(1-aminocyclopropyl)methyl]aniline

N-[(1-aminocyclopropyl)methyl]aniline (PubChem CID 65460018) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is N-[(1-aminocyclopropyl)methyl]aniline.

Molecular Properties

Compound NameN-[(1-aminocyclopropyl)methyl]aniline
PubChem CID65460018
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC NameN-[(1-aminocyclopropyl)methyl]aniline
SMILESNC1(CNc2ccccc2)CC1
InChIInChI=1S/C10H14N2/c11-10(6-7-10)8-12-9-4-2-1-3-5-9/h1-5,12H,6-8,11H2
InChIKeyWCGFKFSJIIYPCA-UHFFFAOYSA-N
XLogP1.59
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(1-aminocyclopropyl)methyl]aniline?
The IUPAC name of N-[(1-aminocyclopropyl)methyl]aniline (CID 65460018) is N-[(1-aminocyclopropyl)methyl]aniline.
What is the SMILES notation for N-[(1-aminocyclopropyl)methyl]aniline?
The canonical SMILES for N-[(1-aminocyclopropyl)methyl]aniline is NC1(CNc2ccccc2)CC1.
What is the InChIKey of N-[(1-aminocyclopropyl)methyl]aniline?
The InChIKey is WCGFKFSJIIYPCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2/c11-10(6-7-10)8-12-9-4-2-1-3-5-9/h1-5,12H,6-8,11H2.
What are the key properties of N-[(1-aminocyclopropyl)methyl]aniline?
N-[(1-aminocyclopropyl)methyl]aniline has a molecular weight of 162.24 g/mol, XLogP of 1.59, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-aminocyclopropyl)methyl]aniline is sourced from PubChem (CID 65460018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).