carbamic acid;1,2-dimethylcyclohexan-1-amine

C9H20N2O2 — CID 175425918

IUPACcarbamic acid;1,2-dimethylcyclohexan-1-amine
SMILESCC1CCCCC1(C)N.NC(=O)O
InChIInChI=1S/C8H17N.CH3NO2/c1-7-5-3-4-6-8(7,2)9;2-1(3)4/h7H,3-6,9H2,1-2H3;2H2,(H,3,4)
InChIKeyKDRAQWJUKPNOIJ-UHFFFAOYSA-N
MW188.27 g/mol
LogP1.54
Rot. Bonds

About carbamic acid;1,2-dimethylcyclohexan-1-amine

carbamic acid;1,2-dimethylcyclohexan-1-amine (PubChem CID 175425918) has the molecular formula C9H20N2O2 and a molecular weight of 188.27 g/mol. Its IUPAC name is carbamic acid;1,2-dimethylcyclohexan-1-amine.

Molecular Properties

Compound Namecarbamic acid;1,2-dimethylcyclohexan-1-amine
PubChem CID175425918
Molecular FormulaC9H20N2O2
Molecular Weight188.27 g/mol
Exact Mass188.15
IUPAC Namecarbamic acid;1,2-dimethylcyclohexan-1-amine
SMILESCC1CCCCC1(C)N.NC(=O)O
InChIInChI=1S/C8H17N.CH3NO2/c1-7-5-3-4-6-8(7,2)9;2-1(3)4/h7H,3-6,9H2,1-2H3;2H2,(H,3,4)
InChIKeyKDRAQWJUKPNOIJ-UHFFFAOYSA-N
XLogP1.54
TPSA89.34 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 51.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

carbonic acid;1,2-dimethylcyclohexan-1-amine
CID 173050882
benzoic acid;1,2-dimethylcyclohexan-1-amine
CID 173305473
1,2-dimethylcyclopentan-1-amine;hydrochloride
CID 146050243
dibutylcarbamothioic S-acid;1,2-dimethylcyclohexan-1-amine
CID 173387095
1,2-dimethylcyclohexan-1-amine;4-methylmorpholine
CID 67592701
(1R)-1,2-dimethylcyclobutan-1-amine
CID 147198625
2-methylcyclohexane-1,1-diamine;pentanedioic acid
CID 175047098
(3aR,7aS)-3a-methyl-1,2,3,4,5,6,7,7a-octahydroindene-1-carboxylic acid
CID 15322398
1,2-dimethylcyclobutan-1-amine;formic acid
CID 175124192
trans-methyl (1R,2R)-2-amino-2-methylcyclohexane-1-carboxylate
CID 96839903
1-[(2,2-dimethylcyclopropyl)amino]-2-methylcyclohexane-1-carboxylic acid
CID 115000314
methanol;1,1,2-trimethylcyclohexane
CID 70292509

Frequently Asked Questions

What is the IUPAC name of carbamic acid;1,2-dimethylcyclohexan-1-amine?
The IUPAC name of carbamic acid;1,2-dimethylcyclohexan-1-amine (CID 175425918) is carbamic acid;1,2-dimethylcyclohexan-1-amine.
What is the SMILES notation for carbamic acid;1,2-dimethylcyclohexan-1-amine?
The canonical SMILES for carbamic acid;1,2-dimethylcyclohexan-1-amine is CC1CCCCC1(C)N.NC(=O)O.
What is the InChIKey of carbamic acid;1,2-dimethylcyclohexan-1-amine?
The InChIKey is KDRAQWJUKPNOIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N.CH3NO2/c1-7-5-3-4-6-8(7,2)9;2-1(3)4/h7H,3-6,9H2,1-2H3;2H2,(H,3,4).
What are the key properties of carbamic acid;1,2-dimethylcyclohexan-1-amine?
carbamic acid;1,2-dimethylcyclohexan-1-amine has a molecular weight of 188.27 g/mol, XLogP of 1.54, 0 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for carbamic acid;1,2-dimethylcyclohexan-1-amine is sourced from PubChem (CID 175425918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).