N-(cyclopropylmethyl)-3-[4-(piperidin-4-ylmethyl)phenyl]propanamide;hydrochloride

C19H29ClN2O — CID 146064790

IUPACN-(cyclopropylmethyl)-3-[4-(piperidin-4-ylmethyl)phenyl]propanamide;hydrochloride
SMILESCl.O=C(CCc1ccc(CC2CCNCC2)cc1)NCC1CC1
InChIInChI=1S/C19H28N2O.ClH/c22-19(21-14-18-5-6-18)8-7-15-1-3-16(4-2-15)13-17-9-11-20-12-10-17;/h1-4,17-18,20H,5-14H2,(H,21,22);1H
InChIKeyKEWHUTHCRADQEK-UHFFFAOYSA-N
MW336.91 g/mol
LogP3.11
Rot. Bonds7

About N-(cyclopropylmethyl)-3-[4-(piperidin-4-ylmethyl)phenyl]propanamide;hydrochloride

N-(cyclopropylmethyl)-3-[4-(piperidin-4-ylmethyl)phenyl]propanamide;hydrochloride (PubChem CID 146064790) has the molecular formula C19H29ClN2O and a molecular weight of 336.91 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-3-[4-(piperidin-4-ylmethyl)phenyl]propanamide;hydrochloride.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-3-[4-(piperidin-4-ylmethyl)phenyl]propanamide;hydrochloride
PubChem CID146064790
Molecular FormulaC19H29ClN2O
Molecular Weight336.91 g/mol
Exact Mass336.20
IUPAC NameN-(cyclopropylmethyl)-3-[4-(piperidin-4-ylmethyl)phenyl]propanamide;hydrochloride
SMILESCl.O=C(CCc1ccc(CC2CCNCC2)cc1)NCC1CC1
InChIInChI=1S/C19H28N2O.ClH/c22-19(21-14-18-5-6-18)8-7-15-1-3-16(4-2-15)13-17-9-11-20-12-10-17;/h1-4,17-18,20H,5-14H2,(H,21,22);1H
InChIKeyKEWHUTHCRADQEK-UHFFFAOYSA-N
XLogP3.11
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.91
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(cyclopropylmethyl)-3-[4-(piperidin-4-ylmethyl)phenyl]propanamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(4-fluorophenyl)-N-(pyrrolidin-3-ylmethyl)propanamide;hydrochloride
CID 91660400
3-(4-aminophenyl)-N-(cyclopropylmethyl)propanamide
CID 43309173
N-(cyclopropylmethyl)-3-phenylpropanamide
CID 51076426
3-(4-methoxyphenyl)-N-(2-piperidin-4-ylethyl)propanamide
CID 60902718
3-(4-aminophenyl)-N-(cyclopentylmethyl)propanamide
CID 43371351
2-(4-methylphenyl)-N-(piperidin-4-ylmethyl)acetamide
CID 43152403
methyl 2-[4-(piperidin-4-ylmethyl)phenyl]acetate
CID 118703296
N-[(4-bromocyclohexyl)methyl]-3-(4-methoxyphenyl)propanamide
CID 106134334
3-(3-methylphenyl)-N-(pyrrolidin-3-ylmethyl)propanamide
CID 80563288
3-(2-fluorophenyl)-N-(pyrrolidin-3-ylmethyl)propanamide
CID 115271910
4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(piperidin-4-ylmethyl)butanamide
CID 167751742
3-(4-methylphenyl)-N-[2-oxo-2-(piperidin-3-ylmethylamino)ethyl]propanamide
CID 119462114

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-3-[4-(piperidin-4-ylmethyl)phenyl]propanamide;hydrochloride?
The IUPAC name of N-(cyclopropylmethyl)-3-[4-(piperidin-4-ylmethyl)phenyl]propanamide;hydrochloride (CID 146064790) is N-(cyclopropylmethyl)-3-[4-(piperidin-4-ylmethyl)phenyl]propanamide;hydrochloride.
What is the SMILES notation for N-(cyclopropylmethyl)-3-[4-(piperidin-4-ylmethyl)phenyl]propanamide;hydrochloride?
The canonical SMILES for N-(cyclopropylmethyl)-3-[4-(piperidin-4-ylmethyl)phenyl]propanamide;hydrochloride is Cl.O=C(CCc1ccc(CC2CCNCC2)cc1)NCC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-3-[4-(piperidin-4-ylmethyl)phenyl]propanamide;hydrochloride?
The InChIKey is KEWHUTHCRADQEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O.ClH/c22-19(21-14-18-5-6-18)8-7-15-1-3-16(4-2-15)13-17-9-11-20-12-10-17;/h1-4,17-18,20H,5-14H2,(H,21,22);1H.
What are the key properties of N-(cyclopropylmethyl)-3-[4-(piperidin-4-ylmethyl)phenyl]propanamide;hydrochloride?
N-(cyclopropylmethyl)-3-[4-(piperidin-4-ylmethyl)phenyl]propanamide;hydrochloride has a molecular weight of 336.91 g/mol, XLogP of 3.11, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-3-[4-(piperidin-4-ylmethyl)phenyl]propanamide;hydrochloride is sourced from PubChem (CID 146064790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).