2-cyclopropyl-2-(ethylamino)-3-(2-propylimidazol-1-yl)propan-1-ol

C14H25N3O — CID 64809827

IUPAC2-cyclopropyl-2-(ethylamino)-3-(2-propylimidazol-1-yl)propan-1-ol
SMILESCCCc1nccn1CC(CO)(NCC)C1CC1
InChIInChI=1S/C14H25N3O/c1-3-5-13-15-8-9-17(13)10-14(11-18,16-4-2)12-6-7-12/h8-9,12,16,18H,3-7,10-11H2,1-2H3
InChIKeyMJUNCNDVFFADQQ-UHFFFAOYSA-N
MW251.37 g/mol
LogP1.59
Rot. Bonds8

About 2-cyclopropyl-2-(ethylamino)-3-(2-propylimidazol-1-yl)propan-1-ol

2-cyclopropyl-2-(ethylamino)-3-(2-propylimidazol-1-yl)propan-1-ol (PubChem CID 64809827) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is 2-cyclopropyl-2-(ethylamino)-3-(2-propylimidazol-1-yl)propan-1-ol.

Molecular Properties

Compound Name2-cyclopropyl-2-(ethylamino)-3-(2-propylimidazol-1-yl)propan-1-ol
PubChem CID64809827
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC Name2-cyclopropyl-2-(ethylamino)-3-(2-propylimidazol-1-yl)propan-1-ol
SMILESCCCc1nccn1CC(CO)(NCC)C1CC1
InChIInChI=1S/C14H25N3O/c1-3-5-13-15-8-9-17(13)10-14(11-18,16-4-2)12-6-7-12/h8-9,12,16,18H,3-7,10-11H2,1-2H3
InChIKeyMJUNCNDVFFADQQ-UHFFFAOYSA-N
XLogP1.59
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclopropyl-3-(4,5-dimethylimidazol-1-yl)-2-(ethylamino)propan-1-ol
CID 64810648
2-cyclopropyl-3-[methyl-[(1-methylimidazol-2-yl)methyl]amino]-2-(propylamino)propan-1-ol
CID 64789493
2,2-dimethyl-N-propyl-3-(2-propylimidazol-1-yl)propan-1-amine
CID 79621146
2-ethyl-2-(propylamino)-5-(2-propylimidazol-1-yl)pentan-1-ol
CID 106809992
2-(ethylamino)-3-(2-propylimidazol-1-yl)propan-1-ol
CID 64810250
3-(4-chloro-5-methylpyrazol-1-yl)-2-cyclopropyl-2-(ethylamino)propan-1-ol
CID 64811575
2-cyclopropyl-2-(ethylamino)-3-(3,4,5-trimethylpyrazol-1-yl)propan-1-ol
CID 64811763
2-cyclopropyl-3-(2-ethylimidazol-1-yl)-2-(propylamino)propanamide
CID 63919908
(2-butylimidazol-1-yl)methanol
CID 22012500
2-cyclopropyl-2-(ethylamino)-3-(1H-imidazol-2-ylsulfanyl)propan-1-ol
CID 107784607
2,2-dimethyl-6-(2-propylimidazol-1-yl)cyclohexan-1-ol
CID 79847201
N-[1-cyclopentyl-2-(2-propylimidazol-1-yl)ethyl]propan-1-amine
CID 104747735

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-(ethylamino)-3-(2-propylimidazol-1-yl)propan-1-ol?
The IUPAC name of 2-cyclopropyl-2-(ethylamino)-3-(2-propylimidazol-1-yl)propan-1-ol (CID 64809827) is 2-cyclopropyl-2-(ethylamino)-3-(2-propylimidazol-1-yl)propan-1-ol.
What is the SMILES notation for 2-cyclopropyl-2-(ethylamino)-3-(2-propylimidazol-1-yl)propan-1-ol?
The canonical SMILES for 2-cyclopropyl-2-(ethylamino)-3-(2-propylimidazol-1-yl)propan-1-ol is CCCc1nccn1CC(CO)(NCC)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-(ethylamino)-3-(2-propylimidazol-1-yl)propan-1-ol?
The InChIKey is MJUNCNDVFFADQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-3-5-13-15-8-9-17(13)10-14(11-18,16-4-2)12-6-7-12/h8-9,12,16,18H,3-7,10-11H2,1-2H3.
What are the key properties of 2-cyclopropyl-2-(ethylamino)-3-(2-propylimidazol-1-yl)propan-1-ol?
2-cyclopropyl-2-(ethylamino)-3-(2-propylimidazol-1-yl)propan-1-ol has a molecular weight of 251.37 g/mol, XLogP of 1.59, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-(ethylamino)-3-(2-propylimidazol-1-yl)propan-1-ol is sourced from PubChem (CID 64809827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).