(5-amino-2,4-dimethylcyclohexyl)-[(2R,6S)-2,6-dimethylpiperidin-1-yl]methanone

C16H30N2O — CID 102706941

IUPAC(5-amino-2,4-dimethylcyclohexyl)-[(2R,6S)-2,6-dimethylpiperidin-1-yl]methanone
SMILESCC1CC(C)C(C(=O)N2[C@H](C)CCC[C@@H]2C)CC1N
InChIInChI=1S/C16H30N2O/c1-10-8-11(2)15(17)9-14(10)16(19)18-12(3)6-5-7-13(18)4/h10-15H,5-9,17H2,1-4H3/t10?,11?,12-,13+,14?,15?
InChIKeyKVAPBOSAPBYFKM-NEYLYKIESA-N
MW266.43 g/mol
LogP2.79
Rot. Bonds1

About (5-amino-2,4-dimethylcyclohexyl)-[(2R,6S)-2,6-dimethylpiperidin-1-yl]methanone

(5-amino-2,4-dimethylcyclohexyl)-[(2R,6S)-2,6-dimethylpiperidin-1-yl]methanone (PubChem CID 102706941) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is (5-amino-2,4-dimethylcyclohexyl)-[(2R,6S)-2,6-dimethylpiperidin-1-yl]methanone.

Molecular Properties

Compound Name(5-amino-2,4-dimethylcyclohexyl)-[(2R,6S)-2,6-dimethylpiperidin-1-yl]methanone
PubChem CID102706941
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name(5-amino-2,4-dimethylcyclohexyl)-[(2R,6S)-2,6-dimethylpiperidin-1-yl]methanone
SMILESCC1CC(C)C(C(=O)N2[C@H](C)CCC[C@@H]2C)CC1N
InChIInChI=1S/C16H30N2O/c1-10-8-11(2)15(17)9-14(10)16(19)18-12(3)6-5-7-13(18)4/h10-15H,5-9,17H2,1-4H3/t10?,11?,12-,13+,14?,15?
InChIKeyKVAPBOSAPBYFKM-NEYLYKIESA-N
XLogP2.79
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (5-amino-2,4-dimethylcyclohexyl)-[(2R,6S)-2,6-dimethylpiperidin-1-yl]methanone with MolForge

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Related Compounds

(5-amino-2,4-dimethylcyclohexyl)-(2-methylpyrrolidin-1-yl)methanone
CID 102706440
(2-aminocyclopentyl)-(2,6-dimethylpiperidin-1-yl)methanone
CID 64816010
(2,5-dimethylpyrrolidin-1-yl)-[(1R,2R)-2-methylcyclopropyl]methanone
CID 130610130
2-(2,6-dimethylpiperidine-1-carbonyl)cyclopropane-1-carboxylic acid
CID 60791393
(5-amino-2,4-dimethylcyclohexyl)-(2,4-dimethylpyrrolidin-1-yl)methanone
CID 102706928
(5-amino-2,4-dimethylcyclohexyl)-(3,5-dimethylpiperidin-1-yl)methanone
CID 102706478
[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-(5-amino-2,4-dimethylcyclohexyl)methanone
CID 102728751
cis-(1R,2S)-2-[(2R,6S)-2,6-dimethylpiperidine-1-carbonyl]cyclohexane-1-carboxylic acid
CID 124523302
(5-amino-2,4-dimethylcyclohexyl)-(4-propan-2-ylazepan-1-yl)methanone
CID 102706777
(5-amino-2,4-dimethylcyclohexyl)-[3-(dimethylamino)pyrrolidin-1-yl]methanone
CID 102706729
cyclopropyl-[(2R,6R)-2,6-dimethylpiperidin-1-yl]methanone
CID 130610084
(5-amino-2,4-dimethylcyclohexyl)-(3,3-dimethylpyrrolidin-1-yl)methanone
CID 102706831

Frequently Asked Questions

What is the IUPAC name of (5-amino-2,4-dimethylcyclohexyl)-[(2R,6S)-2,6-dimethylpiperidin-1-yl]methanone?
The IUPAC name of (5-amino-2,4-dimethylcyclohexyl)-[(2R,6S)-2,6-dimethylpiperidin-1-yl]methanone (CID 102706941) is (5-amino-2,4-dimethylcyclohexyl)-[(2R,6S)-2,6-dimethylpiperidin-1-yl]methanone.
What is the SMILES notation for (5-amino-2,4-dimethylcyclohexyl)-[(2R,6S)-2,6-dimethylpiperidin-1-yl]methanone?
The canonical SMILES for (5-amino-2,4-dimethylcyclohexyl)-[(2R,6S)-2,6-dimethylpiperidin-1-yl]methanone is CC1CC(C)C(C(=O)N2[C@H](C)CCC[C@@H]2C)CC1N.
What is the InChIKey of (5-amino-2,4-dimethylcyclohexyl)-[(2R,6S)-2,6-dimethylpiperidin-1-yl]methanone?
The InChIKey is KVAPBOSAPBYFKM-NEYLYKIESA-N. The full InChI is InChI=1S/C16H30N2O/c1-10-8-11(2)15(17)9-14(10)16(19)18-12(3)6-5-7-13(18)4/h10-15H,5-9,17H2,1-4H3/t10?,11?,12-,13+,14?,15?.
What are the key properties of (5-amino-2,4-dimethylcyclohexyl)-[(2R,6S)-2,6-dimethylpiperidin-1-yl]methanone?
(5-amino-2,4-dimethylcyclohexyl)-[(2R,6S)-2,6-dimethylpiperidin-1-yl]methanone has a molecular weight of 266.43 g/mol, XLogP of 2.79, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-amino-2,4-dimethylcyclohexyl)-[(2R,6S)-2,6-dimethylpiperidin-1-yl]methanone is sourced from PubChem (CID 102706941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).