N-cyclopropyl-4-(oxolan-3-ylmethylamino)benzamide

C15H20N2O2 — CID 43687551

IUPACN-cyclopropyl-4-(oxolan-3-ylmethylamino)benzamide
SMILESO=C(NC1CC1)c1ccc(NCC2CCOC2)cc1
InChIInChI=1S/C15H20N2O2/c18-15(17-14-5-6-14)12-1-3-13(4-2-12)16-9-11-7-8-19-10-11/h1-4,11,14,16H,5-10H2,(H,17,18)
InChIKeyQTPDICNNCCIOMZ-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.03
Rot. Bonds5

About N-cyclopropyl-4-(oxolan-3-ylmethylamino)benzamide

N-cyclopropyl-4-(oxolan-3-ylmethylamino)benzamide (PubChem CID 43687551) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is N-cyclopropyl-4-(oxolan-3-ylmethylamino)benzamide.

Molecular Properties

Compound NameN-cyclopropyl-4-(oxolan-3-ylmethylamino)benzamide
PubChem CID43687551
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC NameN-cyclopropyl-4-(oxolan-3-ylmethylamino)benzamide
SMILESO=C(NC1CC1)c1ccc(NCC2CCOC2)cc1
InChIInChI=1S/C15H20N2O2/c18-15(17-14-5-6-14)12-1-3-13(4-2-12)16-9-11-7-8-19-10-11/h1-4,11,14,16H,5-10H2,(H,17,18)
InChIKeyQTPDICNNCCIOMZ-UHFFFAOYSA-N
XLogP2.03
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-4-(oxan-3-ylmethylamino)benzamide
CID 63737546
4-(oxolan-3-ylmethylamino)-N-prop-2-enylbenzamide
CID 54865698
N-[4-(oxolan-3-ylmethylamino)phenyl]cyclopropanecarboxamide
CID 43204093
4-N-(oxolan-3-ylmethyl)benzene-1,4-diamine
CID 62824000
4-(ethylamino)-N-(oxan-3-ylmethyl)benzamide
CID 62175319
N-cyclopropyl-4-methoxy-3-[[(3R)-oxolan-3-yl]methylcarbamoylamino]benzamide
CID 125161688
4-(methylamino)-N-[2-(oxolan-3-yl)ethyl]benzamide
CID 114131493
4-hydroxy-N-(oxolan-3-yl)benzamide
CID 80713158
N-cyclopropyl-4-(pentylamino)benzamide
CID 43687480
N-(oxan-4-yl)-4-(1,2-oxazol-3-ylmethylamino)benzamide
CID 71973649
4-fluoro-3-(oxolan-3-ylmethylamino)benzoic acid
CID 43728204
N-cyclopropyl-4-(methylamino)benzamide
CID 62170956

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-(oxolan-3-ylmethylamino)benzamide?
The IUPAC name of N-cyclopropyl-4-(oxolan-3-ylmethylamino)benzamide (CID 43687551) is N-cyclopropyl-4-(oxolan-3-ylmethylamino)benzamide.
What is the SMILES notation for N-cyclopropyl-4-(oxolan-3-ylmethylamino)benzamide?
The canonical SMILES for N-cyclopropyl-4-(oxolan-3-ylmethylamino)benzamide is O=C(NC1CC1)c1ccc(NCC2CCOC2)cc1.
What is the InChIKey of N-cyclopropyl-4-(oxolan-3-ylmethylamino)benzamide?
The InChIKey is QTPDICNNCCIOMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c18-15(17-14-5-6-14)12-1-3-13(4-2-12)16-9-11-7-8-19-10-11/h1-4,11,14,16H,5-10H2,(H,17,18).
What are the key properties of N-cyclopropyl-4-(oxolan-3-ylmethylamino)benzamide?
N-cyclopropyl-4-(oxolan-3-ylmethylamino)benzamide has a molecular weight of 260.34 g/mol, XLogP of 2.03, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-(oxolan-3-ylmethylamino)benzamide is sourced from PubChem (CID 43687551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).