N-(2-cyclopropyl-2-hydroxyethyl)-2-(propylamino)benzamide

C15H22N2O2 — CID 63297170

IUPACN-(2-cyclopropyl-2-hydroxyethyl)-2-(propylamino)benzamide
SMILESCCCNc1ccccc1C(=O)NCC(O)C1CC1
InChIInChI=1S/C15H22N2O2/c1-2-9-16-13-6-4-3-5-12(13)15(19)17-10-14(18)11-7-8-11/h3-6,11,14,16,18H,2,7-10H2,1H3,(H,17,19)
InChIKeyCNTNSKQRYGEASR-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.01
Rot. Bonds7

About N-(2-cyclopropyl-2-hydroxyethyl)-2-(propylamino)benzamide

N-(2-cyclopropyl-2-hydroxyethyl)-2-(propylamino)benzamide (PubChem CID 63297170) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-(2-cyclopropyl-2-hydroxyethyl)-2-(propylamino)benzamide.

Molecular Properties

Compound NameN-(2-cyclopropyl-2-hydroxyethyl)-2-(propylamino)benzamide
PubChem CID63297170
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-(2-cyclopropyl-2-hydroxyethyl)-2-(propylamino)benzamide
SMILESCCCNc1ccccc1C(=O)NCC(O)C1CC1
InChIInChI=1S/C15H22N2O2/c1-2-9-16-13-6-4-3-5-12(13)15(19)17-10-14(18)11-7-8-11/h3-6,11,14,16,18H,2,7-10H2,1H3,(H,17,19)
InChIKeyCNTNSKQRYGEASR-UHFFFAOYSA-N
XLogP2.01
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,2-diethoxyethyl)-2-(propylamino)benzamide
CID 79538539
N-[(4-methylcyclohexyl)methyl]-2-(propylamino)benzamide
CID 63501540
N-[2-(cyclopropylamino)-2-oxoethyl]-2-(propylamino)benzamide
CID 62168218
N-(cyclohex-3-en-1-ylmethyl)-2-(propylamino)benzamide
CID 63108480
N-cyclooctyl-2-(propylamino)benzamide
CID 63500402
3-[[2-(propylamino)benzoyl]amino]propanoic acid
CID 63107977
N-(3-hydroxypropyl)-2-(propylamino)benzamide
CID 55178627
N-[(2S)-2-cyclopropyl-2-hydroxyethyl]-2-(trifluoromethyl)benzamide
CID 95388210
2-(2-bromoethylamino)-N-propylbenzamide
CID 11066007
2-(propylamino)-N-(thiolan-2-ylmethyl)benzamide
CID 80586609
N-[3-oxo-3-(propylamino)propyl]-2-(propylamino)benzamide
CID 62178281
N-(2-chloroprop-2-enyl)-2-(propylamino)benzamide
CID 113464736

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopropyl-2-hydroxyethyl)-2-(propylamino)benzamide?
The IUPAC name of N-(2-cyclopropyl-2-hydroxyethyl)-2-(propylamino)benzamide (CID 63297170) is N-(2-cyclopropyl-2-hydroxyethyl)-2-(propylamino)benzamide.
What is the SMILES notation for N-(2-cyclopropyl-2-hydroxyethyl)-2-(propylamino)benzamide?
The canonical SMILES for N-(2-cyclopropyl-2-hydroxyethyl)-2-(propylamino)benzamide is CCCNc1ccccc1C(=O)NCC(O)C1CC1.
What is the InChIKey of N-(2-cyclopropyl-2-hydroxyethyl)-2-(propylamino)benzamide?
The InChIKey is CNTNSKQRYGEASR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-2-9-16-13-6-4-3-5-12(13)15(19)17-10-14(18)11-7-8-11/h3-6,11,14,16,18H,2,7-10H2,1H3,(H,17,19).
What are the key properties of N-(2-cyclopropyl-2-hydroxyethyl)-2-(propylamino)benzamide?
N-(2-cyclopropyl-2-hydroxyethyl)-2-(propylamino)benzamide has a molecular weight of 262.35 g/mol, XLogP of 2.01, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropyl-2-hydroxyethyl)-2-(propylamino)benzamide is sourced from PubChem (CID 63297170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).