2-(cyclopropylmethylamino)-N-(1-oxo-3-phenyl-1-pyrrolidin-1-ylpropan-2-yl)acetamide;hydrochloride

C19H28ClN3O2 — CID 119762010

IUPAC2-(cyclopropylmethylamino)-N-(1-oxo-3-phenyl-1-pyrrolidin-1-ylpropan-2-yl)acetamide;hydrochloride
SMILESCl.O=C(CNCC1CC1)NC(Cc1ccccc1)C(=O)N1CCCC1
InChIInChI=1S/C19H27N3O2.ClH/c23-18(14-20-13-16-8-9-16)21-17(12-15-6-2-1-3-7-15)19(24)22-10-4-5-11-22;/h1-3,6-7,16-17,20H,4-5,8-14H2,(H,21,23);1H
InChIKeyPSPIGYJRDRRTQM-UHFFFAOYSA-N
MW365.91 g/mol
LogP1.76
Rot. Bonds8

About 2-(cyclopropylmethylamino)-N-(1-oxo-3-phenyl-1-pyrrolidin-1-ylpropan-2-yl)acetamide;hydrochloride

2-(cyclopropylmethylamino)-N-(1-oxo-3-phenyl-1-pyrrolidin-1-ylpropan-2-yl)acetamide;hydrochloride (PubChem CID 119762010) has the molecular formula C19H28ClN3O2 and a molecular weight of 365.91 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-N-(1-oxo-3-phenyl-1-pyrrolidin-1-ylpropan-2-yl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-N-(1-oxo-3-phenyl-1-pyrrolidin-1-ylpropan-2-yl)acetamide;hydrochloride
PubChem CID119762010
Molecular FormulaC19H28ClN3O2
Molecular Weight365.91 g/mol
Exact Mass365.19
IUPAC Name2-(cyclopropylmethylamino)-N-(1-oxo-3-phenyl-1-pyrrolidin-1-ylpropan-2-yl)acetamide;hydrochloride
SMILESCl.O=C(CNCC1CC1)NC(Cc1ccccc1)C(=O)N1CCCC1
InChIInChI=1S/C19H27N3O2.ClH/c23-18(14-20-13-16-8-9-16)21-17(12-15-6-2-1-3-7-15)19(24)22-10-4-5-11-22;/h1-3,6-7,16-17,20H,4-5,8-14H2,(H,21,23);1H
InChIKeyPSPIGYJRDRRTQM-UHFFFAOYSA-N
XLogP1.76
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.91
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-N-(1-oxo-3-phenyl-1-pyrrolidin-1-ylpropan-2-yl)acetamide;hydrochloride?
The IUPAC name of 2-(cyclopropylmethylamino)-N-(1-oxo-3-phenyl-1-pyrrolidin-1-ylpropan-2-yl)acetamide;hydrochloride (CID 119762010) is 2-(cyclopropylmethylamino)-N-(1-oxo-3-phenyl-1-pyrrolidin-1-ylpropan-2-yl)acetamide;hydrochloride.
What is the SMILES notation for 2-(cyclopropylmethylamino)-N-(1-oxo-3-phenyl-1-pyrrolidin-1-ylpropan-2-yl)acetamide;hydrochloride?
The canonical SMILES for 2-(cyclopropylmethylamino)-N-(1-oxo-3-phenyl-1-pyrrolidin-1-ylpropan-2-yl)acetamide;hydrochloride is Cl.O=C(CNCC1CC1)NC(Cc1ccccc1)C(=O)N1CCCC1.
What is the InChIKey of 2-(cyclopropylmethylamino)-N-(1-oxo-3-phenyl-1-pyrrolidin-1-ylpropan-2-yl)acetamide;hydrochloride?
The InChIKey is PSPIGYJRDRRTQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N3O2.ClH/c23-18(14-20-13-16-8-9-16)21-17(12-15-6-2-1-3-7-15)19(24)22-10-4-5-11-22;/h1-3,6-7,16-17,20H,4-5,8-14H2,(H,21,23);1H.
What are the key properties of 2-(cyclopropylmethylamino)-N-(1-oxo-3-phenyl-1-pyrrolidin-1-ylpropan-2-yl)acetamide;hydrochloride?
2-(cyclopropylmethylamino)-N-(1-oxo-3-phenyl-1-pyrrolidin-1-ylpropan-2-yl)acetamide;hydrochloride has a molecular weight of 365.91 g/mol, XLogP of 1.76, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-N-(1-oxo-3-phenyl-1-pyrrolidin-1-ylpropan-2-yl)acetamide;hydrochloride is sourced from PubChem (CID 119762010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).