1-cyclopropyl-N-[(1-methylcyclopropyl)methyl]methanamine

C9H17N — CID 103724422

IUPAC1-cyclopropyl-N-[(1-methylcyclopropyl)methyl]methanamine
SMILESCC1(CNCC2CC2)CC1
InChIInChI=1S/C9H17N/c1-9(4-5-9)7-10-6-8-2-3-8/h8,10H,2-7H2,1H3
InChIKeyMFSTUFCXQBAIMN-UHFFFAOYSA-N
MW139.24 g/mol
LogP1.79
Rot. Bonds4

About 1-cyclopropyl-N-[(1-methylcyclopropyl)methyl]methanamine

1-cyclopropyl-N-[(1-methylcyclopropyl)methyl]methanamine (PubChem CID 103724422) has the molecular formula C9H17N and a molecular weight of 139.24 g/mol. Its IUPAC name is 1-cyclopropyl-N-[(1-methylcyclopropyl)methyl]methanamine.

Molecular Properties

Compound Name1-cyclopropyl-N-[(1-methylcyclopropyl)methyl]methanamine
PubChem CID103724422
Molecular FormulaC9H17N
Molecular Weight139.24 g/mol
Exact Mass139.14
IUPAC Name1-cyclopropyl-N-[(1-methylcyclopropyl)methyl]methanamine
SMILESCC1(CNCC2CC2)CC1
InChIInChI=1S/C9H17N/c1-9(4-5-9)7-10-6-8-2-3-8/h8,10H,2-7H2,1H3
InChIKeyMFSTUFCXQBAIMN-UHFFFAOYSA-N
XLogP1.79
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.24
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[(1-methylcyclopropyl)methyl]methanamine?
The IUPAC name of 1-cyclopropyl-N-[(1-methylcyclopropyl)methyl]methanamine (CID 103724422) is 1-cyclopropyl-N-[(1-methylcyclopropyl)methyl]methanamine.
What is the SMILES notation for 1-cyclopropyl-N-[(1-methylcyclopropyl)methyl]methanamine?
The canonical SMILES for 1-cyclopropyl-N-[(1-methylcyclopropyl)methyl]methanamine is CC1(CNCC2CC2)CC1.
What is the InChIKey of 1-cyclopropyl-N-[(1-methylcyclopropyl)methyl]methanamine?
The InChIKey is MFSTUFCXQBAIMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N/c1-9(4-5-9)7-10-6-8-2-3-8/h8,10H,2-7H2,1H3.
What are the key properties of 1-cyclopropyl-N-[(1-methylcyclopropyl)methyl]methanamine?
1-cyclopropyl-N-[(1-methylcyclopropyl)methyl]methanamine has a molecular weight of 139.24 g/mol, XLogP of 1.79, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[(1-methylcyclopropyl)methyl]methanamine is sourced from PubChem (CID 103724422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).