3-[cyclopropyl(ethyl)amino]-2-methyl-2-(propylamino)propan-1-ol

C12H26N2O — CID 64798088

IUPAC3-[cyclopropyl(ethyl)amino]-2-methyl-2-(propylamino)propan-1-ol
SMILESCCCNC(C)(CO)CN(CC)C1CC1
InChIInChI=1S/C12H26N2O/c1-4-8-13-12(3,10-15)9-14(5-2)11-6-7-11/h11,13,15H,4-10H2,1-3H3
InChIKeyOLJKQIKWGPDGIM-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.22
Rot. Bonds8

About 3-[cyclopropyl(ethyl)amino]-2-methyl-2-(propylamino)propan-1-ol

3-[cyclopropyl(ethyl)amino]-2-methyl-2-(propylamino)propan-1-ol (PubChem CID 64798088) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 3-[cyclopropyl(ethyl)amino]-2-methyl-2-(propylamino)propan-1-ol.

Molecular Properties

Compound Name3-[cyclopropyl(ethyl)amino]-2-methyl-2-(propylamino)propan-1-ol
PubChem CID64798088
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name3-[cyclopropyl(ethyl)amino]-2-methyl-2-(propylamino)propan-1-ol
SMILESCCCNC(C)(CO)CN(CC)C1CC1
InChIInChI=1S/C12H26N2O/c1-4-8-13-12(3,10-15)9-14(5-2)11-6-7-11/h11,13,15H,4-10H2,1-3H3
InChIKeyOLJKQIKWGPDGIM-UHFFFAOYSA-N
XLogP1.22
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[cyclopropyl(ethyl)amino]-2-methyl-2-(propan-2-ylamino)propan-1-ol
CID 64798308
3-[cyclopentyl(ethyl)amino]-2-methyl-2-(methylamino)propan-1-ol
CID 64797688
3-[cyclopentyl(ethyl)amino]-2-cyclopropyl-2-(propylamino)propan-1-ol
CID 64797055
3-[cyclopropylmethyl(methyl)amino]-2-methyl-2-(propylamino)propan-1-ol
CID 64825469
3-[cyclohexyl(ethyl)amino]-2-cyclopropyl-2-(propylamino)propan-1-ol
CID 64798182
2-methyl-4-[methyl-(4-methylcyclohexyl)amino]-2-(propylamino)pentan-1-ol
CID 64827999
3-[cyclohexylmethyl(methyl)amino]-2-methyl-2-(propylamino)propan-1-ol
CID 64826426
3-[ethyl(propan-2-yl)amino]-2-methyl-2-(propylamino)propan-1-ol
CID 64795479
2-methyl-6-[methyl-(4-methylcyclohexyl)amino]-2-(propylamino)hexan-1-ol
CID 64827792
3-[3,3-dimethylbutan-2-yl(methyl)amino]-2-methyl-2-(propylamino)propan-1-ol
CID 64827091
N-(2,2-dimethylpropyl)-N-ethylcyclopropanamine
CID 67816379
1-[ethyl-(4-methylcyclohexyl)amino]-2-methylpropan-2-ol
CID 79389933

Frequently Asked Questions

What is the IUPAC name of 3-[cyclopropyl(ethyl)amino]-2-methyl-2-(propylamino)propan-1-ol?
The IUPAC name of 3-[cyclopropyl(ethyl)amino]-2-methyl-2-(propylamino)propan-1-ol (CID 64798088) is 3-[cyclopropyl(ethyl)amino]-2-methyl-2-(propylamino)propan-1-ol.
What is the SMILES notation for 3-[cyclopropyl(ethyl)amino]-2-methyl-2-(propylamino)propan-1-ol?
The canonical SMILES for 3-[cyclopropyl(ethyl)amino]-2-methyl-2-(propylamino)propan-1-ol is CCCNC(C)(CO)CN(CC)C1CC1.
What is the InChIKey of 3-[cyclopropyl(ethyl)amino]-2-methyl-2-(propylamino)propan-1-ol?
The InChIKey is OLJKQIKWGPDGIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-4-8-13-12(3,10-15)9-14(5-2)11-6-7-11/h11,13,15H,4-10H2,1-3H3.
What are the key properties of 3-[cyclopropyl(ethyl)amino]-2-methyl-2-(propylamino)propan-1-ol?
3-[cyclopropyl(ethyl)amino]-2-methyl-2-(propylamino)propan-1-ol has a molecular weight of 214.35 g/mol, XLogP of 1.22, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[cyclopropyl(ethyl)amino]-2-methyl-2-(propylamino)propan-1-ol is sourced from PubChem (CID 64798088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).