N-propan-2-yl-N-prop-2-enylcyclobutanamine

C10H19N — CID 131208595

IUPACN-propan-2-yl-N-prop-2-enylcyclobutanamine
SMILESC=CCN(C(C)C)C1CCC1
InChIInChI=1S/C10H19N/c1-4-8-11(9(2)3)10-6-5-7-10/h4,9-10H,1,5-8H2,2-3H3
InChIKeyNICJMTVOKCTTFD-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.44
Rot. Bonds4

About N-propan-2-yl-N-prop-2-enylcyclobutanamine

N-propan-2-yl-N-prop-2-enylcyclobutanamine (PubChem CID 131208595) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is N-propan-2-yl-N-prop-2-enylcyclobutanamine.

Molecular Properties

Compound NameN-propan-2-yl-N-prop-2-enylcyclobutanamine
PubChem CID131208595
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC NameN-propan-2-yl-N-prop-2-enylcyclobutanamine
SMILESC=CCN(C(C)C)C1CCC1
InChIInChI=1S/C10H19N/c1-4-8-11(9(2)3)10-6-5-7-10/h4,9-10H,1,5-8H2,2-3H3
InChIKeyNICJMTVOKCTTFD-UHFFFAOYSA-N
XLogP2.44
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-propan-2-yl-N-prop-2-enylcyclobutanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-N-prop-2-enylcyclobutanamine?
The IUPAC name of N-propan-2-yl-N-prop-2-enylcyclobutanamine (CID 131208595) is N-propan-2-yl-N-prop-2-enylcyclobutanamine.
What is the SMILES notation for N-propan-2-yl-N-prop-2-enylcyclobutanamine?
The canonical SMILES for N-propan-2-yl-N-prop-2-enylcyclobutanamine is C=CCN(C(C)C)C1CCC1.
What is the InChIKey of N-propan-2-yl-N-prop-2-enylcyclobutanamine?
The InChIKey is NICJMTVOKCTTFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-4-8-11(9(2)3)10-6-5-7-10/h4,9-10H,1,5-8H2,2-3H3.
What are the key properties of N-propan-2-yl-N-prop-2-enylcyclobutanamine?
N-propan-2-yl-N-prop-2-enylcyclobutanamine has a molecular weight of 153.27 g/mol, XLogP of 2.44, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-N-prop-2-enylcyclobutanamine is sourced from PubChem (CID 131208595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).