1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-2-methylpropan-2-ol

C14H27NO — CID 63239236

IUPAC1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-2-methylpropan-2-ol
SMILESCC(C)(O)CNC1CCC2CCCCC2C1
InChIInChI=1S/C14H27NO/c1-14(2,16)10-15-13-8-7-11-5-3-4-6-12(11)9-13/h11-13,15-16H,3-10H2,1-2H3
InChIKeyCCYQIIGUXDBKHC-UHFFFAOYSA-N
MW225.38 g/mol
LogP2.71
Rot. Bonds3

About 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-2-methylpropan-2-ol

1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-2-methylpropan-2-ol (PubChem CID 63239236) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-2-methylpropan-2-ol
PubChem CID63239236
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-2-methylpropan-2-ol
SMILESCC(C)(O)CNC1CCC2CCCCC2C1
InChIInChI=1S/C14H27NO/c1-14(2,16)10-15-13-8-7-11-5-3-4-6-12(11)9-13/h11-13,15-16H,3-10H2,1-2H3
InChIKeyCCYQIIGUXDBKHC-UHFFFAOYSA-N
XLogP2.71
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-2-methylpropan-2-ol with MolForge

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Related Compounds

3-cyclopropyl-N-(2,2-dimethylpropyl)cyclohexan-1-amine
CID 64624615
3-cyclopropyl-N-(2,2,3-trimethylbutyl)cyclohexan-1-amine
CID 114099437
(2R)-N-ethyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine
CID 167179387
1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-3-methylbutan-2-ol
CID 115720450
2-methyl-1-[[(1R,3S)-3-methylcyclohexyl]amino]propan-2-ol
CID 93346375
(2S)-5-[[(1R,3R)-3-cyclopropylcyclohexyl]amino]-4,4-dimethylpentan-2-ol
CID 124864824
2-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)acetic acid
CID 43774214
1-[(3-methoxycyclohexyl)amino]-2-methylpropan-2-ol
CID 65107402
1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-2-methylpropan-2-ol
CID 19985530
2-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-N,N-dimethylacetamide
CID 43224493
N-(2-methylsulfanylethyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine
CID 60663658
N-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)hydroxylamine
CID 82684932

Frequently Asked Questions

What is the IUPAC name of 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-2-methylpropan-2-ol?
The IUPAC name of 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-2-methylpropan-2-ol (CID 63239236) is 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-2-methylpropan-2-ol.
What is the SMILES notation for 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-2-methylpropan-2-ol?
The canonical SMILES for 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-2-methylpropan-2-ol is CC(C)(O)CNC1CCC2CCCCC2C1.
What is the InChIKey of 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-2-methylpropan-2-ol?
The InChIKey is CCYQIIGUXDBKHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-14(2,16)10-15-13-8-7-11-5-3-4-6-12(11)9-13/h11-13,15-16H,3-10H2,1-2H3.
What are the key properties of 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-2-methylpropan-2-ol?
1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-2-methylpropan-2-ol has a molecular weight of 225.38 g/mol, XLogP of 2.71, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-2-methylpropan-2-ol is sourced from PubChem (CID 63239236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).