4,7-dimethyltricyclo[6.2.0.03,10]decane-2,9-diamine

C12H22N2 — CID 135258769

IUPAC4,7-dimethyltricyclo[6.2.0.03,10]decane-2,9-diamine
SMILESCC1CCC(C)C2C(N)C3C1C(N)C23
InChIInChI=1S/C12H22N2/c1-5-3-4-6(2)8-10-9(12(8)14)7(5)11(10)13/h5-12H,3-4,13-14H2,1-2H3
InChIKeyNPZFHYQXQRYGCE-UHFFFAOYSA-N
MW194.32 g/mol
LogP1.20
Rot. Bonds

About 4,7-dimethyltricyclo[6.2.0.03,10]decane-2,9-diamine

4,7-dimethyltricyclo[6.2.0.03,10]decane-2,9-diamine (PubChem CID 135258769) has the molecular formula C12H22N2 and a molecular weight of 194.32 g/mol. Its IUPAC name is 4,7-dimethyltricyclo[6.2.0.03,10]decane-2,9-diamine.

Molecular Properties

Compound Name4,7-dimethyltricyclo[6.2.0.03,10]decane-2,9-diamine
PubChem CID135258769
Molecular FormulaC12H22N2
Molecular Weight194.32 g/mol
Exact Mass194.18
IUPAC Name4,7-dimethyltricyclo[6.2.0.03,10]decane-2,9-diamine
SMILESCC1CCC(C)C2C(N)C3C1C(N)C23
InChIInChI=1S/C12H22N2/c1-5-3-4-6(2)8-10-9(12(8)14)7(5)11(10)13/h5-12H,3-4,13-14H2,1-2H3
InChIKeyNPZFHYQXQRYGCE-UHFFFAOYSA-N
XLogP1.20
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(3S,3aR,4R,7S,7aR)-3,7-dimethyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-amine
CID 166959719
2-cyclopropyl-1,3-dimethylcyclopentane
CID 154518239
(6R)-1,6-dimethyl-1,2,3,3a,4,5,6,6a-octahydropentalene
CID 147576937
ethane;2-ethyl-5-methylcyclopentan-1-amine
CID 176686280
(1S,2R,3S,6R)-2-fluoro-3,6-dimethylcyclohexan-1-amine
CID 125452174
(1R,2R,5R)-2-fluoro-5-methylcyclopentan-1-amine
CID 125452095
CID 169427116
CID 169427116
(1R)-2-methyl-5-(2-methylpropyl)cyclopentan-1-amine
CID 163689367
(1S,2R,3R,3aS,6R,6aS)-3,6-dimethyl-1,2,3,3a,4,5,6,6a-octahydropentalene-1,2-diol
CID 130927438
(1R,2R,3S)-2-amino-3-methylcyclopentane-1-carboxylic acid
CID 95757427
trans-(1R,2R)-2-methylcyclopropan-1-amine
CID 12953691
cis-(1S,3R)-1,2,3-trimethylcyclopentane
CID 6427077

Frequently Asked Questions

What is the IUPAC name of 4,7-dimethyltricyclo[6.2.0.03,10]decane-2,9-diamine?
The IUPAC name of 4,7-dimethyltricyclo[6.2.0.03,10]decane-2,9-diamine (CID 135258769) is 4,7-dimethyltricyclo[6.2.0.03,10]decane-2,9-diamine.
What is the SMILES notation for 4,7-dimethyltricyclo[6.2.0.03,10]decane-2,9-diamine?
The canonical SMILES for 4,7-dimethyltricyclo[6.2.0.03,10]decane-2,9-diamine is CC1CCC(C)C2C(N)C3C1C(N)C23.
What is the InChIKey of 4,7-dimethyltricyclo[6.2.0.03,10]decane-2,9-diamine?
The InChIKey is NPZFHYQXQRYGCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2/c1-5-3-4-6(2)8-10-9(12(8)14)7(5)11(10)13/h5-12H,3-4,13-14H2,1-2H3.
What are the key properties of 4,7-dimethyltricyclo[6.2.0.03,10]decane-2,9-diamine?
4,7-dimethyltricyclo[6.2.0.03,10]decane-2,9-diamine has a molecular weight of 194.32 g/mol, XLogP of 1.20, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,7-dimethyltricyclo[6.2.0.03,10]decane-2,9-diamine is sourced from PubChem (CID 135258769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).