4-[[2-(cyclopropylmethylamino)acetyl]amino]-2-piperidin-1-ylbenzamide;hydrochloride

C18H27ClN4O2 — CID 119786105

IUPAC4-[[2-(cyclopropylmethylamino)acetyl]amino]-2-piperidin-1-ylbenzamide;hydrochloride
SMILESCl.NC(=O)c1ccc(NC(=O)CNCC2CC2)cc1N1CCCCC1
InChIInChI=1S/C18H26N4O2.ClH/c19-18(24)15-7-6-14(10-16(15)22-8-2-1-3-9-22)21-17(23)12-20-11-13-4-5-13;/h6-7,10,13,20H,1-5,8-9,11-12H2,(H2,19,24)(H,21,23);1H
InChIKeyQPHLRKIQXRKTDH-UHFFFAOYSA-N
MW366.89 g/mol
LogP2.14
Rot. Bonds7

About 4-[[2-(cyclopropylmethylamino)acetyl]amino]-2-piperidin-1-ylbenzamide;hydrochloride

4-[[2-(cyclopropylmethylamino)acetyl]amino]-2-piperidin-1-ylbenzamide;hydrochloride (PubChem CID 119786105) has the molecular formula C18H27ClN4O2 and a molecular weight of 366.89 g/mol. Its IUPAC name is 4-[[2-(cyclopropylmethylamino)acetyl]amino]-2-piperidin-1-ylbenzamide;hydrochloride.

Molecular Properties

Compound Name4-[[2-(cyclopropylmethylamino)acetyl]amino]-2-piperidin-1-ylbenzamide;hydrochloride
PubChem CID119786105
Molecular FormulaC18H27ClN4O2
Molecular Weight366.89 g/mol
Exact Mass366.18
IUPAC Name4-[[2-(cyclopropylmethylamino)acetyl]amino]-2-piperidin-1-ylbenzamide;hydrochloride
SMILESCl.NC(=O)c1ccc(NC(=O)CNCC2CC2)cc1N1CCCCC1
InChIInChI=1S/C18H26N4O2.ClH/c19-18(24)15-7-6-14(10-16(15)22-8-2-1-3-9-22)21-17(23)12-20-11-13-4-5-13;/h6-7,10,13,20H,1-5,8-9,11-12H2,(H2,19,24)(H,21,23);1H
InChIKeyQPHLRKIQXRKTDH-UHFFFAOYSA-N
XLogP2.14
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.89
LogP ≤ 52.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 4-[[2-(cyclopropylmethylamino)acetyl]amino]-2-piperidin-1-ylbenzamide;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

2-piperidin-1-yl-4-[(2-pyrrolidin-2-ylacetyl)amino]benzamide;hydrochloride
CID 119786123
4-acetamido-2-piperidin-1-ylbenzamide
CID 69312911
4-[4-(methylamino)butanoylamino]-2-piperidin-1-ylbenzamide;hydrochloride
CID 119786091
4-[[(2S)-2-aminobutanoyl]amino]-2-piperidin-1-ylbenzamide;hydrochloride
CID 119325043
4-[[2-(cyclopropylmethylamino)acetyl]amino]benzamide;hydrochloride
CID 119672411
2-(cyclopropylmethylamino)-N-(3-pyrrolidin-1-ylphenyl)acetamide
CID 60928462
2-(cyclopropylmethylamino)-N-(3,4-dimethylphenyl)acetamide;hydrochloride
CID 119670640
2-piperidin-1-yl-4-(pyridin-4-ylmethylamino)benzamide
CID 122131807
2-(cyclopropylmethylamino)-N-[3-(1,1-dioxo-1,2-thiazolidin-2-yl)-4-methylphenyl]acetamide
CID 119798756
N-[4-[[2-(cyclopropylmethylamino)acetyl]amino]phenyl]cyclopropanecarboxamide;hydrochloride
CID 119700150
2-(cyclopropylmethylamino)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide
CID 60841575
2-(cyclopropylmethylamino)-N-[4-methyl-3-[(2-piperidin-1-ylacetyl)amino]phenyl]acetamide
CID 119865177

Frequently Asked Questions

What is the IUPAC name of 4-[[2-(cyclopropylmethylamino)acetyl]amino]-2-piperidin-1-ylbenzamide;hydrochloride?
The IUPAC name of 4-[[2-(cyclopropylmethylamino)acetyl]amino]-2-piperidin-1-ylbenzamide;hydrochloride (CID 119786105) is 4-[[2-(cyclopropylmethylamino)acetyl]amino]-2-piperidin-1-ylbenzamide;hydrochloride.
What is the SMILES notation for 4-[[2-(cyclopropylmethylamino)acetyl]amino]-2-piperidin-1-ylbenzamide;hydrochloride?
The canonical SMILES for 4-[[2-(cyclopropylmethylamino)acetyl]amino]-2-piperidin-1-ylbenzamide;hydrochloride is Cl.NC(=O)c1ccc(NC(=O)CNCC2CC2)cc1N1CCCCC1.
What is the InChIKey of 4-[[2-(cyclopropylmethylamino)acetyl]amino]-2-piperidin-1-ylbenzamide;hydrochloride?
The InChIKey is QPHLRKIQXRKTDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O2.ClH/c19-18(24)15-7-6-14(10-16(15)22-8-2-1-3-9-22)21-17(23)12-20-11-13-4-5-13;/h6-7,10,13,20H,1-5,8-9,11-12H2,(H2,19,24)(H,21,23);1H.
What are the key properties of 4-[[2-(cyclopropylmethylamino)acetyl]amino]-2-piperidin-1-ylbenzamide;hydrochloride?
4-[[2-(cyclopropylmethylamino)acetyl]amino]-2-piperidin-1-ylbenzamide;hydrochloride has a molecular weight of 366.89 g/mol, XLogP of 2.14, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(cyclopropylmethylamino)acetyl]amino]-2-piperidin-1-ylbenzamide;hydrochloride is sourced from PubChem (CID 119786105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).