4-hydroxy-N-[(1-propoxycyclohexyl)methyl]pyrrolidine-2-carboxamide

C15H28N2O3 — CID 119819505

IUPAC4-hydroxy-N-[(1-propoxycyclohexyl)methyl]pyrrolidine-2-carboxamide
SMILESCCCOC1(CNC(=O)C2CC(O)CN2)CCCCC1
InChIInChI=1S/C15H28N2O3/c1-2-8-20-15(6-4-3-5-7-15)11-17-14(19)13-9-12(18)10-16-13/h12-13,16,18H,2-11H2,1H3,(H,17,19)
InChIKeyRYGVMWFVTJPAAP-UHFFFAOYSA-N
MW284.40 g/mol
LogP0.95
Rot. Bonds6

About 4-hydroxy-N-[(1-propoxycyclohexyl)methyl]pyrrolidine-2-carboxamide

4-hydroxy-N-[(1-propoxycyclohexyl)methyl]pyrrolidine-2-carboxamide (PubChem CID 119819505) has the molecular formula C15H28N2O3 and a molecular weight of 284.40 g/mol. Its IUPAC name is 4-hydroxy-N-[(1-propoxycyclohexyl)methyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name4-hydroxy-N-[(1-propoxycyclohexyl)methyl]pyrrolidine-2-carboxamide
PubChem CID119819505
Molecular FormulaC15H28N2O3
Molecular Weight284.40 g/mol
Exact Mass284.21
IUPAC Name4-hydroxy-N-[(1-propoxycyclohexyl)methyl]pyrrolidine-2-carboxamide
SMILESCCCOC1(CNC(=O)C2CC(O)CN2)CCCCC1
InChIInChI=1S/C15H28N2O3/c1-2-8-20-15(6-4-3-5-7-15)11-17-14(19)13-9-12(18)10-16-13/h12-13,16,18H,2-11H2,1H3,(H,17,19)
InChIKeyRYGVMWFVTJPAAP-UHFFFAOYSA-N
XLogP0.95
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 50.95
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-hydroxy-N-[(1-propylcyclobutyl)methyl]pyrrolidine-2-carboxamide
CID 119821714
4-hydroxy-N-[(1-methylcyclobutyl)methyl]pyrrolidine-2-carboxamide
CID 103812334
N-[[1-(dimethylcarbamoyl)cyclopentyl]methyl]-4-hydroxypyrrolidine-2-carboxamide
CID 119786154
(2S,4R)-4-hydroxy-N-[[(1R,2R)-2-hydroxy-1-methylcyclohexyl]methyl]pyrrolidine-2-carboxamide
CID 125150294
(2R,4S)-N-ethyl-4-hydroxypyrrolidine-2-carboxamide
CID 28943534
4-hydroxy-N-[[1-(2-methylpropyl)cyclopropyl]methyl]pyrrolidine-2-carboxamide
CID 119821380
(2R,4R)-4-hydroxy-N-[[1-(4-methoxyphenyl)cyclopentyl]methyl]pyrrolidine-2-carboxamide
CID 74230276
(2S,4S)-4-hydroxy-N-[(1-morpholin-4-ylcyclohexyl)methyl]pyrrolidine-2-carboxamide
CID 125150968
4-hydroxy-N-octylpyrrolidine-2-carboxamide
CID 113337253
4-hydroxy-N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]pyrrolidine-2-carboxamide
CID 119747052
4-hydroxy-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]pyrrolidine-2-carboxamide
CID 106101637
(2S,4S)-N-[2-(dimethylamino)ethyl]-4-hydroxypyrrolidine-2-carboxamide
CID 28943524

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-[(1-propoxycyclohexyl)methyl]pyrrolidine-2-carboxamide?
The IUPAC name of 4-hydroxy-N-[(1-propoxycyclohexyl)methyl]pyrrolidine-2-carboxamide (CID 119819505) is 4-hydroxy-N-[(1-propoxycyclohexyl)methyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for 4-hydroxy-N-[(1-propoxycyclohexyl)methyl]pyrrolidine-2-carboxamide?
The canonical SMILES for 4-hydroxy-N-[(1-propoxycyclohexyl)methyl]pyrrolidine-2-carboxamide is CCCOC1(CNC(=O)C2CC(O)CN2)CCCCC1.
What is the InChIKey of 4-hydroxy-N-[(1-propoxycyclohexyl)methyl]pyrrolidine-2-carboxamide?
The InChIKey is RYGVMWFVTJPAAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O3/c1-2-8-20-15(6-4-3-5-7-15)11-17-14(19)13-9-12(18)10-16-13/h12-13,16,18H,2-11H2,1H3,(H,17,19).
What are the key properties of 4-hydroxy-N-[(1-propoxycyclohexyl)methyl]pyrrolidine-2-carboxamide?
4-hydroxy-N-[(1-propoxycyclohexyl)methyl]pyrrolidine-2-carboxamide has a molecular weight of 284.40 g/mol, XLogP of 0.95, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-[(1-propoxycyclohexyl)methyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 119819505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).