[1-[2-(diethylamino)ethylamino]-3-methylcyclobutyl]methanol

C12H26N2O — CID 103564776

IUPAC[1-[2-(diethylamino)ethylamino]-3-methylcyclobutyl]methanol
SMILESCCN(CC)CCNC1(CO)CC(C)C1
InChIInChI=1S/C12H26N2O/c1-4-14(5-2)7-6-13-12(10-15)8-11(3)9-12/h11,13,15H,4-10H2,1-3H3
InChIKeyKIVKSLDYSKUSFW-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.08
Rot. Bonds7

About [1-[2-(diethylamino)ethylamino]-3-methylcyclobutyl]methanol

[1-[2-(diethylamino)ethylamino]-3-methylcyclobutyl]methanol (PubChem CID 103564776) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is [1-[2-(diethylamino)ethylamino]-3-methylcyclobutyl]methanol.

Molecular Properties

Compound Name[1-[2-(diethylamino)ethylamino]-3-methylcyclobutyl]methanol
PubChem CID103564776
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name[1-[2-(diethylamino)ethylamino]-3-methylcyclobutyl]methanol
SMILESCCN(CC)CCNC1(CO)CC(C)C1
InChIInChI=1S/C12H26N2O/c1-4-14(5-2)7-6-13-12(10-15)8-11(3)9-12/h11,13,15H,4-10H2,1-3H3
InChIKeyKIVKSLDYSKUSFW-UHFFFAOYSA-N
XLogP1.08
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-[2-(diethylamino)ethylamino]-3-methylcyclobutyl]methanol?
The IUPAC name of [1-[2-(diethylamino)ethylamino]-3-methylcyclobutyl]methanol (CID 103564776) is [1-[2-(diethylamino)ethylamino]-3-methylcyclobutyl]methanol.
What is the SMILES notation for [1-[2-(diethylamino)ethylamino]-3-methylcyclobutyl]methanol?
The canonical SMILES for [1-[2-(diethylamino)ethylamino]-3-methylcyclobutyl]methanol is CCN(CC)CCNC1(CO)CC(C)C1.
What is the InChIKey of [1-[2-(diethylamino)ethylamino]-3-methylcyclobutyl]methanol?
The InChIKey is KIVKSLDYSKUSFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-4-14(5-2)7-6-13-12(10-15)8-11(3)9-12/h11,13,15H,4-10H2,1-3H3.
What are the key properties of [1-[2-(diethylamino)ethylamino]-3-methylcyclobutyl]methanol?
[1-[2-(diethylamino)ethylamino]-3-methylcyclobutyl]methanol has a molecular weight of 214.35 g/mol, XLogP of 1.08, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[2-(diethylamino)ethylamino]-3-methylcyclobutyl]methanol is sourced from PubChem (CID 103564776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).