N-[cyclopropyl-(4-fluorophenyl)methyl]-2-hydroxycyclopentane-1-carboxamide

C16H20FNO2 — CID 110015746

IUPACN-[cyclopropyl-(4-fluorophenyl)methyl]-2-hydroxycyclopentane-1-carboxamide
SMILESO=C(NC(c1ccc(F)cc1)C1CC1)C1CCCC1O
InChIInChI=1S/C16H20FNO2/c17-12-8-6-11(7-9-12)15(10-4-5-10)18-16(20)13-2-1-3-14(13)19/h6-10,13-15,19H,1-5H2,(H,18,20)
InChIKeyNMPPDEWMNWWLHZ-UHFFFAOYSA-N
MW277.34 g/mol
LogP2.55
Rot. Bonds4

About N-[cyclopropyl-(4-fluorophenyl)methyl]-2-hydroxycyclopentane-1-carboxamide

N-[cyclopropyl-(4-fluorophenyl)methyl]-2-hydroxycyclopentane-1-carboxamide (PubChem CID 110015746) has the molecular formula C16H20FNO2 and a molecular weight of 277.34 g/mol. Its IUPAC name is N-[cyclopropyl-(4-fluorophenyl)methyl]-2-hydroxycyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-[cyclopropyl-(4-fluorophenyl)methyl]-2-hydroxycyclopentane-1-carboxamide
PubChem CID110015746
Molecular FormulaC16H20FNO2
Molecular Weight277.34 g/mol
Exact Mass277.15
IUPAC NameN-[cyclopropyl-(4-fluorophenyl)methyl]-2-hydroxycyclopentane-1-carboxamide
SMILESO=C(NC(c1ccc(F)cc1)C1CC1)C1CCCC1O
InChIInChI=1S/C16H20FNO2/c17-12-8-6-11(7-9-12)15(10-4-5-10)18-16(20)13-2-1-3-14(13)19/h6-10,13-15,19H,1-5H2,(H,18,20)
InChIKeyNMPPDEWMNWWLHZ-UHFFFAOYSA-N
XLogP2.55
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.34
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-[cyclobutyl-(4-fluorophenyl)methyl]cyclopentane-1-carboxamide;hydrochloride
CID 119775064
4-amino-N-[cyclobutyl-(4-fluorophenyl)methyl]butanamide
CID 119318592
1-[cyclopropyl-(4-fluorophenyl)methyl]-3-[(1-hydroxycyclopentyl)methyl]urea
CID 111109592
N-[(R)-cyclopentyl-(4-fluorophenyl)methyl]furan-2-carboxamide
CID 51951454
1-tert-butyl-3-[cyclopentyl-(4-fluorophenyl)methyl]urea
CID 112840360
1-[cyclobutyl-(4-fluorophenyl)methyl]-3-[(1-hydroxycyclobutyl)methyl]urea
CID 111438682
N-[cyclobutyl-(4-fluorophenyl)methyl]-4-(methylamino)butanamide
CID 119775061
N-[cyclobutyl-(4-fluorophenyl)methyl]-4-(1-hydroxyethyl)piperidine-1-carboxamide
CID 111438681
1-[cyclobutyl-(4-fluorophenyl)methyl]-3-(3-hydroxybutyl)urea
CID 111337411
1-[cyclopropyl-(4-fluorophenyl)methyl]-3-(3-methylbutyl)urea
CID 86900807
1-[(S)-(4-chlorophenyl)-cyclopropylmethyl]-3-[(1R)-1-(4-fluorophenyl)ethyl]urea
CID 41200264
N-[cyclobutyl-(4-fluorophenyl)methyl]-5-(cyclopropanecarbonylamino)thiophene-2-carboxamide
CID 86891991

Frequently Asked Questions

What is the IUPAC name of N-[cyclopropyl-(4-fluorophenyl)methyl]-2-hydroxycyclopentane-1-carboxamide?
The IUPAC name of N-[cyclopropyl-(4-fluorophenyl)methyl]-2-hydroxycyclopentane-1-carboxamide (CID 110015746) is N-[cyclopropyl-(4-fluorophenyl)methyl]-2-hydroxycyclopentane-1-carboxamide.
What is the SMILES notation for N-[cyclopropyl-(4-fluorophenyl)methyl]-2-hydroxycyclopentane-1-carboxamide?
The canonical SMILES for N-[cyclopropyl-(4-fluorophenyl)methyl]-2-hydroxycyclopentane-1-carboxamide is O=C(NC(c1ccc(F)cc1)C1CC1)C1CCCC1O.
What is the InChIKey of N-[cyclopropyl-(4-fluorophenyl)methyl]-2-hydroxycyclopentane-1-carboxamide?
The InChIKey is NMPPDEWMNWWLHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20FNO2/c17-12-8-6-11(7-9-12)15(10-4-5-10)18-16(20)13-2-1-3-14(13)19/h6-10,13-15,19H,1-5H2,(H,18,20).
What are the key properties of N-[cyclopropyl-(4-fluorophenyl)methyl]-2-hydroxycyclopentane-1-carboxamide?
N-[cyclopropyl-(4-fluorophenyl)methyl]-2-hydroxycyclopentane-1-carboxamide has a molecular weight of 277.34 g/mol, XLogP of 2.55, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclopropyl-(4-fluorophenyl)methyl]-2-hydroxycyclopentane-1-carboxamide is sourced from PubChem (CID 110015746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).