1-cyclopropyl-N-[3-(cyclopropylmethoxy)-2-hydroxypropyl]pyrrole-2-carboxamide

C15H22N2O3 — CID 110007618

IUPAC1-cyclopropyl-N-[3-(cyclopropylmethoxy)-2-hydroxypropyl]pyrrole-2-carboxamide
SMILESO=C(NCC(O)COCC1CC1)c1cccn1C1CC1
InChIInChI=1S/C15H22N2O3/c18-13(10-20-9-11-3-4-11)8-16-15(19)14-2-1-7-17(14)12-5-6-12/h1-2,7,11-13,18H,3-6,8-10H2,(H,16,19)
InChIKeyQFOIZOQHYIIKIS-UHFFFAOYSA-N
MW278.35 g/mol
LogP1.34
Rot. Bonds8

About 1-cyclopropyl-N-[3-(cyclopropylmethoxy)-2-hydroxypropyl]pyrrole-2-carboxamide

1-cyclopropyl-N-[3-(cyclopropylmethoxy)-2-hydroxypropyl]pyrrole-2-carboxamide (PubChem CID 110007618) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is 1-cyclopropyl-N-[3-(cyclopropylmethoxy)-2-hydroxypropyl]pyrrole-2-carboxamide.

Molecular Properties

Compound Name1-cyclopropyl-N-[3-(cyclopropylmethoxy)-2-hydroxypropyl]pyrrole-2-carboxamide
PubChem CID110007618
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC Name1-cyclopropyl-N-[3-(cyclopropylmethoxy)-2-hydroxypropyl]pyrrole-2-carboxamide
SMILESO=C(NCC(O)COCC1CC1)c1cccn1C1CC1
InChIInChI=1S/C15H22N2O3/c18-13(10-20-9-11-3-4-11)8-16-15(19)14-2-1-7-17(14)12-5-6-12/h1-2,7,11-13,18H,3-6,8-10H2,(H,16,19)
InChIKeyQFOIZOQHYIIKIS-UHFFFAOYSA-N
XLogP1.34
TPSA63.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-cyclopropyl-N-[(2S)-2-hydroxypropyl]pyrrole-2-carboxamide
CID 83058739
N-[3-(cyclopropylmethoxy)-2-hydroxypropyl]-2-methylpyrazole-3-carboxamide
CID 111697762
1-cyclobutyl-N-(2-hydroxy-4-methylpentyl)pyrrole-2-carboxamide
CID 107155325
1-cyclobutyl-N-(2-cyclopropyl-2-hydroxyethyl)pyrrole-2-carboxamide
CID 114609590
N-[3-(cyclopropylmethoxy)-2-hydroxypropyl]-2-pyrazol-1-ylbenzamide
CID 111663006
N-[3-(cyclopropylmethoxy)-2-hydroxypropyl]-1-phenylpyrazole-3-carboxamide
CID 111662871
N-[3-(cyclopropylmethoxy)-2-hydroxypropyl]-1-ethylindole-2-carboxamide
CID 111662958
N-[3-(cyclopropylmethoxy)-2-hydroxypropyl]-4-methylbenzamide
CID 111662905
1-cyclopropyl-N-ethylpyrrole-2-carboxamide
CID 130688583
1-cyclopentyl-N-[2-hydroxy-2-(2-methylphenyl)ethyl]pyrrole-2-carboxamide
CID 110007652
1-cyclopropyl-N-(2-hydroxyethyl)pyrrole-2-carboxamide
CID 43639342
N-[(2S)-2-hydroxypropyl]-1-piperidin-4-ylpyrrole-2-carboxamide
CID 107221129

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[3-(cyclopropylmethoxy)-2-hydroxypropyl]pyrrole-2-carboxamide?
The IUPAC name of 1-cyclopropyl-N-[3-(cyclopropylmethoxy)-2-hydroxypropyl]pyrrole-2-carboxamide (CID 110007618) is 1-cyclopropyl-N-[3-(cyclopropylmethoxy)-2-hydroxypropyl]pyrrole-2-carboxamide.
What is the SMILES notation for 1-cyclopropyl-N-[3-(cyclopropylmethoxy)-2-hydroxypropyl]pyrrole-2-carboxamide?
The canonical SMILES for 1-cyclopropyl-N-[3-(cyclopropylmethoxy)-2-hydroxypropyl]pyrrole-2-carboxamide is O=C(NCC(O)COCC1CC1)c1cccn1C1CC1.
What is the InChIKey of 1-cyclopropyl-N-[3-(cyclopropylmethoxy)-2-hydroxypropyl]pyrrole-2-carboxamide?
The InChIKey is QFOIZOQHYIIKIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c18-13(10-20-9-11-3-4-11)8-16-15(19)14-2-1-7-17(14)12-5-6-12/h1-2,7,11-13,18H,3-6,8-10H2,(H,16,19).
What are the key properties of 1-cyclopropyl-N-[3-(cyclopropylmethoxy)-2-hydroxypropyl]pyrrole-2-carboxamide?
1-cyclopropyl-N-[3-(cyclopropylmethoxy)-2-hydroxypropyl]pyrrole-2-carboxamide has a molecular weight of 278.35 g/mol, XLogP of 1.34, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[3-(cyclopropylmethoxy)-2-hydroxypropyl]pyrrole-2-carboxamide is sourced from PubChem (CID 110007618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).