1-N-methyl-1-N-(2-methylcyclopentyl)propane-1,2-diamine

C10H22N2 — CID 130563493

IUPAC1-N-methyl-1-N-(2-methylcyclopentyl)propane-1,2-diamine
SMILESCC(N)CN(C)C1CCCC1C
InChIInChI=1S/C10H22N2/c1-8-5-4-6-10(8)12(3)7-9(2)11/h8-10H,4-7,11H2,1-3H3
InChIKeyFABIJDDPBHHWNA-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.45
Rot. Bonds3

About 1-N-methyl-1-N-(2-methylcyclopentyl)propane-1,2-diamine

1-N-methyl-1-N-(2-methylcyclopentyl)propane-1,2-diamine (PubChem CID 130563493) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is 1-N-methyl-1-N-(2-methylcyclopentyl)propane-1,2-diamine.

Molecular Properties

Compound Name1-N-methyl-1-N-(2-methylcyclopentyl)propane-1,2-diamine
PubChem CID130563493
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC Name1-N-methyl-1-N-(2-methylcyclopentyl)propane-1,2-diamine
SMILESCC(N)CN(C)C1CCCC1C
InChIInChI=1S/C10H22N2/c1-8-5-4-6-10(8)12(3)7-9(2)11/h8-10H,4-7,11H2,1-3H3
InChIKeyFABIJDDPBHHWNA-UHFFFAOYSA-N
XLogP1.45
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-N-methyl-1-N-(2-methylcyclopentyl)propane-1,2-diamine?
The IUPAC name of 1-N-methyl-1-N-(2-methylcyclopentyl)propane-1,2-diamine (CID 130563493) is 1-N-methyl-1-N-(2-methylcyclopentyl)propane-1,2-diamine.
What is the SMILES notation for 1-N-methyl-1-N-(2-methylcyclopentyl)propane-1,2-diamine?
The canonical SMILES for 1-N-methyl-1-N-(2-methylcyclopentyl)propane-1,2-diamine is CC(N)CN(C)C1CCCC1C.
What is the InChIKey of 1-N-methyl-1-N-(2-methylcyclopentyl)propane-1,2-diamine?
The InChIKey is FABIJDDPBHHWNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-8-5-4-6-10(8)12(3)7-9(2)11/h8-10H,4-7,11H2,1-3H3.
What are the key properties of 1-N-methyl-1-N-(2-methylcyclopentyl)propane-1,2-diamine?
1-N-methyl-1-N-(2-methylcyclopentyl)propane-1,2-diamine has a molecular weight of 170.30 g/mol, XLogP of 1.45, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-methyl-1-N-(2-methylcyclopentyl)propane-1,2-diamine is sourced from PubChem (CID 130563493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).