[2-[2-(tert-butylamino)ethylamino]cyclopentyl]methanol

C12H26N2O — CID 106359409

IUPAC[2-[2-(tert-butylamino)ethylamino]cyclopentyl]methanol
SMILESCC(C)(C)NCCNC1CCCC1CO
InChIInChI=1S/C12H26N2O/c1-12(2,3)14-8-7-13-11-6-4-5-10(11)9-15/h10-11,13-15H,4-9H2,1-3H3
InChIKeyWZGGMSQOHHRKPD-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.13
Rot. Bonds5

About [2-[2-(tert-butylamino)ethylamino]cyclopentyl]methanol

[2-[2-(tert-butylamino)ethylamino]cyclopentyl]methanol (PubChem CID 106359409) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is [2-[2-(tert-butylamino)ethylamino]cyclopentyl]methanol.

Molecular Properties

Compound Name[2-[2-(tert-butylamino)ethylamino]cyclopentyl]methanol
PubChem CID106359409
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name[2-[2-(tert-butylamino)ethylamino]cyclopentyl]methanol
SMILESCC(C)(C)NCCNC1CCCC1CO
InChIInChI=1S/C12H26N2O/c1-12(2,3)14-8-7-13-11-6-4-5-10(11)9-15/h10-11,13-15H,4-9H2,1-3H3
InChIKeyWZGGMSQOHHRKPD-UHFFFAOYSA-N
XLogP1.13
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N'-tert-butyl-N-(2-ethylcyclohexyl)ethane-1,2-diamine
CID 107445044
2-[[(1R,2S)-2-(hydroxymethyl)cyclopentyl]amino]ethanol
CID 131230127
tert-butyl N-[[2-[2-(tert-butylamino)ethylamino]cyclopentyl]methyl]carbamate
CID 107446348
2-[[[2-(hydroxymethyl)cyclopentyl]amino]methyl]-2-methylpropane-1,3-diol
CID 106360962
tert-butyl N-[[2-[2-(tert-butylamino)ethylamino]cyclohexyl]methyl]carbamate
CID 107446347
[2-(2-ethylsulfanylethylamino)cyclopentyl]methanol
CID 104668665
1-[[2-(hydroxymethyl)cyclopentyl]amino]-2-methylbutan-2-ol
CID 106361004
[2-(2-propylsulfonylethylamino)cyclopentyl]methanol
CID 106360883
[2-[2-(dimethylamino)ethylamino]cyclohexyl]methanol
CID 104934564
3-[[[2-(hydroxymethyl)cyclopentyl]amino]methyl]pentan-3-ol
CID 106360920
2-[(1S,2S)-2-(3,3-dimethylbutylamino)cyclopentyl]ethanol
CID 99826080
2-(tert-butylamino)-N-[2-(hydroxymethyl)cyclohexyl]acetamide
CID 103860522

Frequently Asked Questions

What is the IUPAC name of [2-[2-(tert-butylamino)ethylamino]cyclopentyl]methanol?
The IUPAC name of [2-[2-(tert-butylamino)ethylamino]cyclopentyl]methanol (CID 106359409) is [2-[2-(tert-butylamino)ethylamino]cyclopentyl]methanol.
What is the SMILES notation for [2-[2-(tert-butylamino)ethylamino]cyclopentyl]methanol?
The canonical SMILES for [2-[2-(tert-butylamino)ethylamino]cyclopentyl]methanol is CC(C)(C)NCCNC1CCCC1CO.
What is the InChIKey of [2-[2-(tert-butylamino)ethylamino]cyclopentyl]methanol?
The InChIKey is WZGGMSQOHHRKPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-12(2,3)14-8-7-13-11-6-4-5-10(11)9-15/h10-11,13-15H,4-9H2,1-3H3.
What are the key properties of [2-[2-(tert-butylamino)ethylamino]cyclopentyl]methanol?
[2-[2-(tert-butylamino)ethylamino]cyclopentyl]methanol has a molecular weight of 214.35 g/mol, XLogP of 1.13, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-(tert-butylamino)ethylamino]cyclopentyl]methanol is sourced from PubChem (CID 106359409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).