1-cyclopropyl-2-methyl-N-propylpropan-1-imine

C10H19N — CID 123343468

IUPAC1-cyclopropyl-2-methyl-N-propylpropan-1-imine
SMILESCCC/N=C(\C(C)C)C1CC1
InChIInChI=1S/C10H19N/c1-4-7-11-10(8(2)3)9-5-6-9/h8-9H,4-7H2,1-3H3/b11-10+
InChIKeyHTLCHEKPWKJZOS-ZHACJKMWSA-N
MW153.27 g/mol
LogP2.90
Rot. Bonds4

About 1-cyclopropyl-2-methyl-N-propylpropan-1-imine

1-cyclopropyl-2-methyl-N-propylpropan-1-imine (PubChem CID 123343468) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is 1-cyclopropyl-2-methyl-N-propylpropan-1-imine.

Molecular Properties

Compound Name1-cyclopropyl-2-methyl-N-propylpropan-1-imine
PubChem CID123343468
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name1-cyclopropyl-2-methyl-N-propylpropan-1-imine
SMILESCCC/N=C(\C(C)C)C1CC1
InChIInChI=1S/C10H19N/c1-4-7-11-10(8(2)3)9-5-6-9/h8-9H,4-7H2,1-3H3/b11-10+
InChIKeyHTLCHEKPWKJZOS-ZHACJKMWSA-N
XLogP2.90
TPSA12.36 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 ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-methyl-N-propylpropan-1-imine?
The IUPAC name of 1-cyclopropyl-2-methyl-N-propylpropan-1-imine (CID 123343468) is 1-cyclopropyl-2-methyl-N-propylpropan-1-imine.
What is the SMILES notation for 1-cyclopropyl-2-methyl-N-propylpropan-1-imine?
The canonical SMILES for 1-cyclopropyl-2-methyl-N-propylpropan-1-imine is CCC/N=C(\C(C)C)C1CC1.
What is the InChIKey of 1-cyclopropyl-2-methyl-N-propylpropan-1-imine?
The InChIKey is HTLCHEKPWKJZOS-ZHACJKMWSA-N. The full InChI is InChI=1S/C10H19N/c1-4-7-11-10(8(2)3)9-5-6-9/h8-9H,4-7H2,1-3H3/b11-10+.
What are the key properties of 1-cyclopropyl-2-methyl-N-propylpropan-1-imine?
1-cyclopropyl-2-methyl-N-propylpropan-1-imine has a molecular weight of 153.27 g/mol, XLogP of 2.90, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-methyl-N-propylpropan-1-imine is sourced from PubChem (CID 123343468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).