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

C10H22N2 — CID 63831246

IUPAC1-N-[(1-methylcyclopentyl)methyl]propane-1,2-diamine
SMILESCC(N)CNCC1(C)CCCC1
InChIInChI=1S/C10H22N2/c1-9(11)7-12-8-10(2)5-3-4-6-10/h9,12H,3-8,11H2,1-2H3
InChIKeyLYNRQPWZQGALIH-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.50
Rot. Bonds4

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

1-N-[(1-methylcyclopentyl)methyl]propane-1,2-diamine (PubChem CID 63831246) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is 1-N-[(1-methylcyclopentyl)methyl]propane-1,2-diamine.

Molecular Properties

Compound Name1-N-[(1-methylcyclopentyl)methyl]propane-1,2-diamine
PubChem CID63831246
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC Name1-N-[(1-methylcyclopentyl)methyl]propane-1,2-diamine
SMILESCC(N)CNCC1(C)CCCC1
InChIInChI=1S/C10H22N2/c1-9(11)7-12-8-10(2)5-3-4-6-10/h9,12H,3-8,11H2,1-2H3
InChIKeyLYNRQPWZQGALIH-UHFFFAOYSA-N
XLogP1.50
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N-[(1-methylcyclobutyl)methyl]propan-1-amine
CID 65196169
2-methyl-1-N-[(1-methylcyclohexyl)methyl]heptane-1,6-diamine
CID 114094981
3,3-dimethyl-1-N-[(1-methylcyclopentyl)methyl]butane-1,2-diamine
CID 112556001
N-ethyl-2-methyl-N'-[(1-methylcyclopentyl)methyl]propane-1,3-diamine
CID 63829803
2-methyl-3-[(1-methylcyclopentyl)methylamino]propanoic acid
CID 63821690
N'-[(1-methylcyclohexyl)methyl]-N-(2-methylpropyl)ethane-1,2-diamine
CID 106827227
2-methoxy-N'-[(1-methylcyclopentyl)methyl]propane-1,3-diamine
CID 106114849
2,2-dimethyl-N'-[(1-methylcyclopentyl)methyl]propane-1,3-diamine
CID 115426986
N'-[(1-methylcyclobutyl)methyl]-1-(4-methylphenyl)ethane-1,2-diamine
CID 106313172
2-methyl-N-[(1-methylcyclopropyl)methyl]butan-1-amine
CID 103897149
(2R)-2-amino-N-[(1-methylcyclohexyl)methyl]propanamide
CID 103798136
2-amino-N-[(1-methylcyclohexyl)methyl]propanamide
CID 103798125

Frequently Asked Questions

What is the IUPAC name of 1-N-[(1-methylcyclopentyl)methyl]propane-1,2-diamine?
The IUPAC name of 1-N-[(1-methylcyclopentyl)methyl]propane-1,2-diamine (CID 63831246) is 1-N-[(1-methylcyclopentyl)methyl]propane-1,2-diamine.
What is the SMILES notation for 1-N-[(1-methylcyclopentyl)methyl]propane-1,2-diamine?
The canonical SMILES for 1-N-[(1-methylcyclopentyl)methyl]propane-1,2-diamine is CC(N)CNCC1(C)CCCC1.
What is the InChIKey of 1-N-[(1-methylcyclopentyl)methyl]propane-1,2-diamine?
The InChIKey is LYNRQPWZQGALIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-9(11)7-12-8-10(2)5-3-4-6-10/h9,12H,3-8,11H2,1-2H3.
What are the key properties of 1-N-[(1-methylcyclopentyl)methyl]propane-1,2-diamine?
1-N-[(1-methylcyclopentyl)methyl]propane-1,2-diamine has a molecular weight of 170.30 g/mol, XLogP of 1.50, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-[(1-methylcyclopentyl)methyl]propane-1,2-diamine is sourced from PubChem (CID 63831246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).