N-cyclopropyl-2-[4-(prop-2-enylcarbamoylamino)piperidin-1-yl]benzamide

C19H26N4O2 — CID 46038566

IUPACN-cyclopropyl-2-[4-(prop-2-enylcarbamoylamino)piperidin-1-yl]benzamide
SMILESC=CCNC(=O)NC1CCN(c2ccccc2C(=O)NC2CC2)CC1
InChIInChI=1S/C19H26N4O2/c1-2-11-20-19(25)22-15-9-12-23(13-10-15)17-6-4-3-5-16(17)18(24)21-14-7-8-14/h2-6,14-15H,1,7-13H2,(H,21,24)(H2,20,22,25)
InChIKeyFHVIYLDNVYPZSF-UHFFFAOYSA-N
MW342.44 g/mol
LogP2.03
Rot. Bonds6

About N-cyclopropyl-2-[4-(prop-2-enylcarbamoylamino)piperidin-1-yl]benzamide

N-cyclopropyl-2-[4-(prop-2-enylcarbamoylamino)piperidin-1-yl]benzamide (PubChem CID 46038566) has the molecular formula C19H26N4O2 and a molecular weight of 342.44 g/mol. Its IUPAC name is N-cyclopropyl-2-[4-(prop-2-enylcarbamoylamino)piperidin-1-yl]benzamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[4-(prop-2-enylcarbamoylamino)piperidin-1-yl]benzamide
PubChem CID46038566
Molecular FormulaC19H26N4O2
Molecular Weight342.44 g/mol
Exact Mass342.21
IUPAC NameN-cyclopropyl-2-[4-(prop-2-enylcarbamoylamino)piperidin-1-yl]benzamide
SMILESC=CCNC(=O)NC1CCN(c2ccccc2C(=O)NC2CC2)CC1
InChIInChI=1S/C19H26N4O2/c1-2-11-20-19(25)22-15-9-12-23(13-10-15)17-6-4-3-5-16(17)18(24)21-14-7-8-14/h2-6,14-15H,1,7-13H2,(H,21,24)(H2,20,22,25)
InChIKeyFHVIYLDNVYPZSF-UHFFFAOYSA-N
XLogP2.03
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 52.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-benzyl-2-[4-(prop-2-enylcarbamoylamino)piperidin-1-yl]benzamide
CID 46038545
N-(3-methylbutan-2-yl)-2-[4-(prop-2-enylcarbamoylamino)piperidin-1-yl]benzamide
CID 46038598
N-(furan-2-ylmethyl)-2-[4-(prop-2-enylcarbamoylamino)piperidin-1-yl]benzamide
CID 42848440
1-[1-[2-(morpholine-4-carbonyl)phenyl]piperidin-4-yl]-3-prop-2-enylurea
CID 46038618
N-[1-[2-(prop-2-enylcarbamoyl)phenyl]piperidin-4-yl]thiophene-2-carboxamide
CID 46156126
2-[4-[(3-methylbenzoyl)amino]piperidin-1-yl]-N-prop-2-enylbenzamide
CID 46037766
2-[4-[(3-chlorophenyl)carbamoylamino]piperidin-1-yl]-N-prop-2-enylbenzamide
CID 46156249
2-[4-(3-phenylpropanoylamino)piperidin-1-yl]-N-prop-2-enylbenzamide
CID 46037750
N-prop-2-enyl-2-[4-[(2-thiophen-2-ylacetyl)amino]piperidin-1-yl]benzamide
CID 42848173
2-(4-aminopiperidin-1-yl)-N-cyclopropylbenzamide
CID 42656462
N-cyclopropyl-2-[4-(2-methylpropanoylamino)piperidin-1-yl]benzamide
CID 42848047
2-piperazin-1-yl-N-prop-2-enylbenzamide
CID 35752648

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[4-(prop-2-enylcarbamoylamino)piperidin-1-yl]benzamide?
The IUPAC name of N-cyclopropyl-2-[4-(prop-2-enylcarbamoylamino)piperidin-1-yl]benzamide (CID 46038566) is N-cyclopropyl-2-[4-(prop-2-enylcarbamoylamino)piperidin-1-yl]benzamide.
What is the SMILES notation for N-cyclopropyl-2-[4-(prop-2-enylcarbamoylamino)piperidin-1-yl]benzamide?
The canonical SMILES for N-cyclopropyl-2-[4-(prop-2-enylcarbamoylamino)piperidin-1-yl]benzamide is C=CCNC(=O)NC1CCN(c2ccccc2C(=O)NC2CC2)CC1.
What is the InChIKey of N-cyclopropyl-2-[4-(prop-2-enylcarbamoylamino)piperidin-1-yl]benzamide?
The InChIKey is FHVIYLDNVYPZSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O2/c1-2-11-20-19(25)22-15-9-12-23(13-10-15)17-6-4-3-5-16(17)18(24)21-14-7-8-14/h2-6,14-15H,1,7-13H2,(H,21,24)(H2,20,22,25).
What are the key properties of N-cyclopropyl-2-[4-(prop-2-enylcarbamoylamino)piperidin-1-yl]benzamide?
N-cyclopropyl-2-[4-(prop-2-enylcarbamoylamino)piperidin-1-yl]benzamide has a molecular weight of 342.44 g/mol, XLogP of 2.03, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[4-(prop-2-enylcarbamoylamino)piperidin-1-yl]benzamide is sourced from PubChem (CID 46038566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).