N-cyclopropyl-3-[(3-phenylcyclobutyl)amino]propanamide

C16H22N2O — CID 79386458

IUPACN-cyclopropyl-3-[(3-phenylcyclobutyl)amino]propanamide
SMILESO=C(CCNC1CC(c2ccccc2)C1)NC1CC1
InChIInChI=1S/C16H22N2O/c19-16(18-14-6-7-14)8-9-17-15-10-13(11-15)12-4-2-1-3-5-12/h1-5,13-15,17H,6-11H2,(H,18,19)
InChIKeyCVZNQXRQWBCYGO-UHFFFAOYSA-N
MW258.36 g/mol
LogP2.19
Rot. Bonds6

About N-cyclopropyl-3-[(3-phenylcyclobutyl)amino]propanamide

N-cyclopropyl-3-[(3-phenylcyclobutyl)amino]propanamide (PubChem CID 79386458) has the molecular formula C16H22N2O and a molecular weight of 258.36 g/mol. Its IUPAC name is N-cyclopropyl-3-[(3-phenylcyclobutyl)amino]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[(3-phenylcyclobutyl)amino]propanamide
PubChem CID79386458
Molecular FormulaC16H22N2O
Molecular Weight258.36 g/mol
Exact Mass258.17
IUPAC NameN-cyclopropyl-3-[(3-phenylcyclobutyl)amino]propanamide
SMILESO=C(CCNC1CC(c2ccccc2)C1)NC1CC1
InChIInChI=1S/C16H22N2O/c19-16(18-14-6-7-14)8-9-17-15-10-13(11-15)12-4-2-1-3-5-12/h1-5,13-15,17H,6-11H2,(H,18,19)
InChIKeyCVZNQXRQWBCYGO-UHFFFAOYSA-N
XLogP2.19
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[(3-phenylcyclobutyl)amino]propanamide?
The IUPAC name of N-cyclopropyl-3-[(3-phenylcyclobutyl)amino]propanamide (CID 79386458) is N-cyclopropyl-3-[(3-phenylcyclobutyl)amino]propanamide.
What is the SMILES notation for N-cyclopropyl-3-[(3-phenylcyclobutyl)amino]propanamide?
The canonical SMILES for N-cyclopropyl-3-[(3-phenylcyclobutyl)amino]propanamide is O=C(CCNC1CC(c2ccccc2)C1)NC1CC1.
What is the InChIKey of N-cyclopropyl-3-[(3-phenylcyclobutyl)amino]propanamide?
The InChIKey is CVZNQXRQWBCYGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c19-16(18-14-6-7-14)8-9-17-15-10-13(11-15)12-4-2-1-3-5-12/h1-5,13-15,17H,6-11H2,(H,18,19).
What are the key properties of N-cyclopropyl-3-[(3-phenylcyclobutyl)amino]propanamide?
N-cyclopropyl-3-[(3-phenylcyclobutyl)amino]propanamide has a molecular weight of 258.36 g/mol, XLogP of 2.19, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[(3-phenylcyclobutyl)amino]propanamide is sourced from PubChem (CID 79386458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).