2-cyclopropyl-2-(ethylamino)-3-(2-methoxy-N-methylanilino)propan-1-ol

C16H26N2O2 — CID 64791730

IUPAC2-cyclopropyl-2-(ethylamino)-3-(2-methoxy-N-methylanilino)propan-1-ol
SMILESCCNC(CO)(CN(C)c1ccccc1OC)C1CC1
InChIInChI=1S/C16H26N2O2/c1-4-17-16(12-19,13-9-10-13)11-18(2)14-7-5-6-8-15(14)20-3/h5-8,13,17,19H,4,9-12H2,1-3H3
InChIKeyDYFQNMHYQJPAHF-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.88
Rot. Bonds8

About 2-cyclopropyl-2-(ethylamino)-3-(2-methoxy-N-methylanilino)propan-1-ol

2-cyclopropyl-2-(ethylamino)-3-(2-methoxy-N-methylanilino)propan-1-ol (PubChem CID 64791730) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 2-cyclopropyl-2-(ethylamino)-3-(2-methoxy-N-methylanilino)propan-1-ol.

Molecular Properties

Compound Name2-cyclopropyl-2-(ethylamino)-3-(2-methoxy-N-methylanilino)propan-1-ol
PubChem CID64791730
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name2-cyclopropyl-2-(ethylamino)-3-(2-methoxy-N-methylanilino)propan-1-ol
SMILESCCNC(CO)(CN(C)c1ccccc1OC)C1CC1
InChIInChI=1S/C16H26N2O2/c1-4-17-16(12-19,13-9-10-13)11-18(2)14-7-5-6-8-15(14)20-3/h5-8,13,17,19H,4,9-12H2,1-3H3
InChIKeyDYFQNMHYQJPAHF-UHFFFAOYSA-N
XLogP1.88
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclopropyl-3-(2-methoxy-N-methylanilino)-2-(propan-2-ylamino)propan-1-ol
CID 64789926
2-cyclopropyl-2-(ethylamino)-3-(2-fluoro-N-methylanilino)propan-1-ol
CID 64791546
2-cyclopropyl-3-(N,3-dimethylanilino)-2-(ethylamino)propan-1-ol
CID 64791529
2-cyclopropyl-3-(2-methoxy-N-methylanilino)-2-(propylamino)propanenitrile
CID 63914238
2-(ethylamino)-4-(2-methoxy-N-methylanilino)-2-methylbutan-1-ol
CID 64791522
2-(ethylamino)-6-(2-methoxy-N-methylanilino)-2-methylhexan-1-ol
CID 64790716
2-cyclopropyl-3-(2-fluoro-N-methylanilino)-2-(methylamino)propan-1-ol
CID 64790739
2-cyclopropyl-2-(2-methoxyanilino)butan-1-ol
CID 64919153
N-cyclopropyl-2,2-diethyl-N'-(2-methoxyphenyl)-N'-methylpropane-1,3-diamine
CID 62259922
N-cyclopropyl-2-ethyl-N'-(2-methoxyphenyl)-N',2-dimethylpropane-1,3-diamine
CID 62260608
N-tert-butyl-2-ethyl-N'-(2-methoxyphenyl)-N',2-dimethylpropane-1,3-diamine
CID 62260778
1-cyclopropyl-N-ethyl-N'-(2-methoxyphenyl)-N'-methylethane-1,2-diamine
CID 63914549

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-(ethylamino)-3-(2-methoxy-N-methylanilino)propan-1-ol?
The IUPAC name of 2-cyclopropyl-2-(ethylamino)-3-(2-methoxy-N-methylanilino)propan-1-ol (CID 64791730) is 2-cyclopropyl-2-(ethylamino)-3-(2-methoxy-N-methylanilino)propan-1-ol.
What is the SMILES notation for 2-cyclopropyl-2-(ethylamino)-3-(2-methoxy-N-methylanilino)propan-1-ol?
The canonical SMILES for 2-cyclopropyl-2-(ethylamino)-3-(2-methoxy-N-methylanilino)propan-1-ol is CCNC(CO)(CN(C)c1ccccc1OC)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-(ethylamino)-3-(2-methoxy-N-methylanilino)propan-1-ol?
The InChIKey is DYFQNMHYQJPAHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-4-17-16(12-19,13-9-10-13)11-18(2)14-7-5-6-8-15(14)20-3/h5-8,13,17,19H,4,9-12H2,1-3H3.
What are the key properties of 2-cyclopropyl-2-(ethylamino)-3-(2-methoxy-N-methylanilino)propan-1-ol?
2-cyclopropyl-2-(ethylamino)-3-(2-methoxy-N-methylanilino)propan-1-ol has a molecular weight of 278.40 g/mol, XLogP of 1.88, 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-methoxy-N-methylanilino)propan-1-ol is sourced from PubChem (CID 64791730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).