4-amino-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butan-1-ol

C14H21NO — CID 116861384

IUPAC4-amino-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butan-1-ol
SMILESNC(CCCO)c1ccc2c(c1)CCCC2
InChIInChI=1S/C14H21NO/c15-14(6-3-9-16)13-8-7-11-4-1-2-5-12(11)10-13/h7-8,10,14,16H,1-6,9,15H2
InChIKeyUNPJIOZLPABUFW-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.34
Rot. Bonds4

About 4-amino-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butan-1-ol

4-amino-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butan-1-ol (PubChem CID 116861384) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 4-amino-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butan-1-ol.

Molecular Properties

Compound Name4-amino-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butan-1-ol
PubChem CID116861384
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name4-amino-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butan-1-ol
SMILESNC(CCCO)c1ccc2c(c1)CCCC2
InChIInChI=1S/C14H21NO/c15-14(6-3-9-16)13-8-7-11-4-1-2-5-12(11)10-13/h7-8,10,14,16H,1-6,9,15H2
InChIKeyUNPJIOZLPABUFW-UHFFFAOYSA-N
XLogP2.34
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-amino-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(5,6,7,8-tetrahydronaphthalen-2-yl)propane-1,3-diamine
CID 116932733
(5S)-5-amino-5-(5,6,7,8-tetrahydronaphthalen-2-yl)pentanoic acid
CID 28931166
1-(5,6,7,8-tetrahydronaphthalen-2-yl)butan-1-amine
CID 43198216
4-(methylamino)-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butan-1-ol
CID 116952908
3-amino-3-(5,6,7,8-tetrahydronaphthalen-2-yl)propanamide
CID 116850923
1-(2,3-dihydro-1H-inden-5-yl)pent-4-en-1-amine
CID 104987476
3-amino-3-(5,6,7,8-tetrahydronaphthalen-2-yl)propanenitrile
CID 116851211
2-methoxy-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine
CID 82283128
ethyl 6-amino-6-(2,3-dihydro-1H-inden-5-yl)hexanoate
CID 60860338
ethyl 4-amino-4-(2,3-dihydro-1H-inden-5-yl)butanoate
CID 54927474
2-(4-methylphenyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine
CID 43152415
2-(4-bromophenyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine
CID 43109357

Frequently Asked Questions

What is the IUPAC name of 4-amino-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butan-1-ol?
The IUPAC name of 4-amino-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butan-1-ol (CID 116861384) is 4-amino-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butan-1-ol.
What is the SMILES notation for 4-amino-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butan-1-ol?
The canonical SMILES for 4-amino-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butan-1-ol is NC(CCCO)c1ccc2c(c1)CCCC2.
What is the InChIKey of 4-amino-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butan-1-ol?
The InChIKey is UNPJIOZLPABUFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c15-14(6-3-9-16)13-8-7-11-4-1-2-5-12(11)10-13/h7-8,10,14,16H,1-6,9,15H2.
What are the key properties of 4-amino-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butan-1-ol?
4-amino-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butan-1-ol has a molecular weight of 219.33 g/mol, XLogP of 2.34, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butan-1-ol is sourced from PubChem (CID 116861384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).