1-N,1-N-dimethyl-3-N-(2-methylcyclopentyl)cyclohexane-1,3-diamine

C14H28N2 — CID 115689711

IUPAC1-N,1-N-dimethyl-3-N-(2-methylcyclopentyl)cyclohexane-1,3-diamine
SMILESCC1CCCC1NC1CCCC(N(C)C)C1
InChIInChI=1S/C14H28N2/c1-11-6-4-9-14(11)15-12-7-5-8-13(10-12)16(2)3/h11-15H,4-10H2,1-3H3
InChIKeyFTTAVEUZFHKFHV-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.64
Rot. Bonds3

About 1-N,1-N-dimethyl-3-N-(2-methylcyclopentyl)cyclohexane-1,3-diamine

1-N,1-N-dimethyl-3-N-(2-methylcyclopentyl)cyclohexane-1,3-diamine (PubChem CID 115689711) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 1-N,1-N-dimethyl-3-N-(2-methylcyclopentyl)cyclohexane-1,3-diamine.

Molecular Properties

Compound Name1-N,1-N-dimethyl-3-N-(2-methylcyclopentyl)cyclohexane-1,3-diamine
PubChem CID115689711
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name1-N,1-N-dimethyl-3-N-(2-methylcyclopentyl)cyclohexane-1,3-diamine
SMILESCC1CCCC1NC1CCCC(N(C)C)C1
InChIInChI=1S/C14H28N2/c1-11-6-4-9-14(11)15-12-7-5-8-13(10-12)16(2)3/h11-15H,4-10H2,1-3H3
InChIKeyFTTAVEUZFHKFHV-UHFFFAOYSA-N
XLogP2.64
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-N-(2-methylcyclohexyl)cyclohexane-1,3-diamine
CID 79458526
N-(3-cyclopropylcyclohexyl)-2-methylcyclohexan-1-amine
CID 64596012
trans-(1S,3S)-1-N,1-N,3-N-trimethylcyclohexane-1,3-diamine
CID 139514025
N-(2-methylcyclopentyl)-3-methylsulfanylcyclohexan-1-amine
CID 115689388
2-methyl-N-(3-propan-2-ylcyclohexyl)cycloheptan-1-amine
CID 107448582
3,4-dimethyl-N-(2-methylcyclohexyl)cyclohexan-1-amine
CID 64731982
cis-(1R,2S)-N-cyclopropyl-2-methylcyclohexan-1-amine
CID 30048017
1-N,1-N-dimethyl-3-N-(oxan-4-yl)cyclohexane-1,3-diamine
CID 115677941
cis-(1S,2R)-2-methyl-N-[(1S,2R)-2-methylcyclopentyl]cyclohexan-1-amine
CID 124708997
1-N-(2-bicyclo[2.2.1]heptanyl)-3-N,3-N-dimethylcyclopentane-1,3-diamine
CID 115897267
2-methyl-N-(3-methylcyclobutyl)cycloheptan-1-amine
CID 104859847
N-(2-methylcyclopentyl)thiolan-3-amine
CID 63277405

Frequently Asked Questions

What is the IUPAC name of 1-N,1-N-dimethyl-3-N-(2-methylcyclopentyl)cyclohexane-1,3-diamine?
The IUPAC name of 1-N,1-N-dimethyl-3-N-(2-methylcyclopentyl)cyclohexane-1,3-diamine (CID 115689711) is 1-N,1-N-dimethyl-3-N-(2-methylcyclopentyl)cyclohexane-1,3-diamine.
What is the SMILES notation for 1-N,1-N-dimethyl-3-N-(2-methylcyclopentyl)cyclohexane-1,3-diamine?
The canonical SMILES for 1-N,1-N-dimethyl-3-N-(2-methylcyclopentyl)cyclohexane-1,3-diamine is CC1CCCC1NC1CCCC(N(C)C)C1.
What is the InChIKey of 1-N,1-N-dimethyl-3-N-(2-methylcyclopentyl)cyclohexane-1,3-diamine?
The InChIKey is FTTAVEUZFHKFHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-11-6-4-9-14(11)15-12-7-5-8-13(10-12)16(2)3/h11-15H,4-10H2,1-3H3.
What are the key properties of 1-N,1-N-dimethyl-3-N-(2-methylcyclopentyl)cyclohexane-1,3-diamine?
1-N,1-N-dimethyl-3-N-(2-methylcyclopentyl)cyclohexane-1,3-diamine has a molecular weight of 224.39 g/mol, XLogP of 2.64, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N-dimethyl-3-N-(2-methylcyclopentyl)cyclohexane-1,3-diamine is sourced from PubChem (CID 115689711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).