1-hydroxy-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopentane-1-carboxamide

C18H26N2O2 — CID 110907044

IUPAC1-hydroxy-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopentane-1-carboxamide
SMILESCN(Cc1ccccc1N1CCCC1)C(=O)C1(O)CCCC1
InChIInChI=1S/C18H26N2O2/c1-19(17(21)18(22)10-4-5-11-18)14-15-8-2-3-9-16(15)20-12-6-7-13-20/h2-3,8-9,22H,4-7,10-14H2,1H3
InChIKeyLTUIEUVWMJMHHK-UHFFFAOYSA-N
MW302.42 g/mol
LogP2.55
Rot. Bonds4

About 1-hydroxy-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopentane-1-carboxamide

1-hydroxy-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopentane-1-carboxamide (PubChem CID 110907044) has the molecular formula C18H26N2O2 and a molecular weight of 302.42 g/mol. Its IUPAC name is 1-hydroxy-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-hydroxy-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopentane-1-carboxamide
PubChem CID110907044
Molecular FormulaC18H26N2O2
Molecular Weight302.42 g/mol
Exact Mass302.20
IUPAC Name1-hydroxy-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopentane-1-carboxamide
SMILESCN(Cc1ccccc1N1CCCC1)C(=O)C1(O)CCCC1
InChIInChI=1S/C18H26N2O2/c1-19(17(21)18(22)10-4-5-11-18)14-15-8-2-3-9-16(15)20-12-6-7-13-20/h2-3,8-9,22H,4-7,10-14H2,1H3
InChIKeyLTUIEUVWMJMHHK-UHFFFAOYSA-N
XLogP2.55
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-hydroxy-N-methyl-N-[(2-morpholin-4-ylphenyl)methyl]cyclopentane-1-carboxamide
CID 110907045
N-benzyl-1-hydroxy-N-methylcyclohexane-1-carboxamide
CID 71857199
2,6-difluoro-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]benzamide
CID 86909479
N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]pyrimidine-5-carboxamide
CID 75484966
1-(4-chlorophenyl)-N-methyl-N-[(2-morpholin-4-ylphenyl)methyl]cyclopentane-1-carboxamide
CID 30777999
3-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-methyl-N-[(2-piperidin-1-ylphenyl)methyl]propanamide
CID 17413624
(3R)-N,3-dimethyl-N-[(2-morpholin-4-ylphenyl)methyl]pyrrolidine-3-carboxamide
CID 124685882
1,3-dimethyl-1-[(2-pyrrolidin-1-ylphenyl)methyl]thiourea
CID 8561901
3-(2-bromophenyl)-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]propanamide
CID 52669946
4-(aminomethyl)-N-methyl-N-[(2-morpholin-4-ylphenyl)methyl]oxane-4-carboxamide
CID 120938284
(3S)-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]pyrrolidine-3-carboxamide
CID 124685812
N,3,4-trimethyl-N-[(2-piperidin-1-ylphenyl)methyl]benzamide
CID 22109708

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopentane-1-carboxamide?
The IUPAC name of 1-hydroxy-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopentane-1-carboxamide (CID 110907044) is 1-hydroxy-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-hydroxy-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-hydroxy-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopentane-1-carboxamide is CN(Cc1ccccc1N1CCCC1)C(=O)C1(O)CCCC1.
What is the InChIKey of 1-hydroxy-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopentane-1-carboxamide?
The InChIKey is LTUIEUVWMJMHHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O2/c1-19(17(21)18(22)10-4-5-11-18)14-15-8-2-3-9-16(15)20-12-6-7-13-20/h2-3,8-9,22H,4-7,10-14H2,1H3.
What are the key properties of 1-hydroxy-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopentane-1-carboxamide?
1-hydroxy-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopentane-1-carboxamide has a molecular weight of 302.42 g/mol, XLogP of 2.55, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 110907044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).