N-cyclopropyl-2-[4-[(2-fluoro-4-methoxyphenyl)carbamoylamino]piperidin-1-yl]acetamide

C18H25FN4O3 — CID 74235645

IUPACN-cyclopropyl-2-[4-[(2-fluoro-4-methoxyphenyl)carbamoylamino]piperidin-1-yl]acetamide
SMILESCOc1ccc(NC(=O)NC2CCN(CC(=O)NC3CC3)CC2)c(F)c1
InChIInChI=1S/C18H25FN4O3/c1-26-14-4-5-16(15(19)10-14)22-18(25)21-13-6-8-23(9-7-13)11-17(24)20-12-2-3-12/h4-5,10,12-13H,2-3,6-9,11H2,1H3,(H,20,24)(H2,21,22,25)
InChIKeyNWZONIKUVFCVDU-UHFFFAOYSA-N
MW364.42 g/mol
LogP1.70
Rot. Bonds6

About N-cyclopropyl-2-[4-[(2-fluoro-4-methoxyphenyl)carbamoylamino]piperidin-1-yl]acetamide

N-cyclopropyl-2-[4-[(2-fluoro-4-methoxyphenyl)carbamoylamino]piperidin-1-yl]acetamide (PubChem CID 74235645) has the molecular formula C18H25FN4O3 and a molecular weight of 364.42 g/mol. Its IUPAC name is N-cyclopropyl-2-[4-[(2-fluoro-4-methoxyphenyl)carbamoylamino]piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[4-[(2-fluoro-4-methoxyphenyl)carbamoylamino]piperidin-1-yl]acetamide
PubChem CID74235645
Molecular FormulaC18H25FN4O3
Molecular Weight364.42 g/mol
Exact Mass364.19
IUPAC NameN-cyclopropyl-2-[4-[(2-fluoro-4-methoxyphenyl)carbamoylamino]piperidin-1-yl]acetamide
SMILESCOc1ccc(NC(=O)NC2CCN(CC(=O)NC3CC3)CC2)c(F)c1
InChIInChI=1S/C18H25FN4O3/c1-26-14-4-5-16(15(19)10-14)22-18(25)21-13-6-8-23(9-7-13)11-17(24)20-12-2-3-12/h4-5,10,12-13H,2-3,6-9,11H2,1H3,(H,20,24)(H2,21,22,25)
InChIKeyNWZONIKUVFCVDU-UHFFFAOYSA-N
XLogP1.70
TPSA82.70 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.42
LogP ≤ 51.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-2-[4-[(4-methoxy-2-methylphenyl)carbamoylamino]piperidin-1-yl]acetamide
CID 118777190
N-cyclopropyl-2-[4-(2-fluoro-4-methoxybenzoyl)piperazin-1-yl]acetamide
CID 86907285
N-(4-chloro-2-fluorophenyl)-2-[4-[2-(cyclopropylamino)-2-oxoethyl]piperazin-1-yl]propanamide
CID 45281448
2-(cyclopropylcarbamoylamino)-4-methoxybenzoic acid
CID 113304992
2-[4-[(4-methoxyphenyl)methylcarbamoylamino]piperidin-1-yl]-N-methylacetamide
CID 34700282
N-cyclopropyl-2-[4-[2-[(2,4-dimethylphenyl)carbamoylamino]-2-oxoethyl]piperazin-1-yl]acetamide
CID 9438309
2-(cyclobutylcarbamoylamino)-5-methoxybenzoic acid
CID 115412235
N-(2,4-difluorophenyl)-2-(4-methoxypiperidin-1-yl)acetamide
CID 47131519
2-fluoro-4-methoxy-N-(1-propylpiperidin-4-yl)benzamide
CID 103603316
1-(1-benzylpiperidin-4-yl)-3-(2,4-difluorophenyl)urea
CID 972217
N-cyclopropyl-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]acetamide
CID 17376128
1-(2-fluorophenyl)-3-[1-[4-(3-methoxyphenyl)benzoyl]piperidin-4-yl]urea
CID 134799087

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[4-[(2-fluoro-4-methoxyphenyl)carbamoylamino]piperidin-1-yl]acetamide?
The IUPAC name of N-cyclopropyl-2-[4-[(2-fluoro-4-methoxyphenyl)carbamoylamino]piperidin-1-yl]acetamide (CID 74235645) is N-cyclopropyl-2-[4-[(2-fluoro-4-methoxyphenyl)carbamoylamino]piperidin-1-yl]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[4-[(2-fluoro-4-methoxyphenyl)carbamoylamino]piperidin-1-yl]acetamide?
The canonical SMILES for N-cyclopropyl-2-[4-[(2-fluoro-4-methoxyphenyl)carbamoylamino]piperidin-1-yl]acetamide is COc1ccc(NC(=O)NC2CCN(CC(=O)NC3CC3)CC2)c(F)c1.
What is the InChIKey of N-cyclopropyl-2-[4-[(2-fluoro-4-methoxyphenyl)carbamoylamino]piperidin-1-yl]acetamide?
The InChIKey is NWZONIKUVFCVDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25FN4O3/c1-26-14-4-5-16(15(19)10-14)22-18(25)21-13-6-8-23(9-7-13)11-17(24)20-12-2-3-12/h4-5,10,12-13H,2-3,6-9,11H2,1H3,(H,20,24)(H2,21,22,25).
What are the key properties of N-cyclopropyl-2-[4-[(2-fluoro-4-methoxyphenyl)carbamoylamino]piperidin-1-yl]acetamide?
N-cyclopropyl-2-[4-[(2-fluoro-4-methoxyphenyl)carbamoylamino]piperidin-1-yl]acetamide has a molecular weight of 364.42 g/mol, XLogP of 1.70, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[4-[(2-fluoro-4-methoxyphenyl)carbamoylamino]piperidin-1-yl]acetamide is sourced from PubChem (CID 74235645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).