2-(cyclopropylmethylamino)-N-[(4-phenoxyphenyl)methyl]acetamide;hydrochloride

C19H23ClN2O2 — CID 119725146

IUPAC2-(cyclopropylmethylamino)-N-[(4-phenoxyphenyl)methyl]acetamide;hydrochloride
SMILESCl.O=C(CNCC1CC1)NCc1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C19H22N2O2.ClH/c22-19(14-20-12-15-6-7-15)21-13-16-8-10-18(11-9-16)23-17-4-2-1-3-5-17;/h1-5,8-11,15,20H,6-7,12-14H2,(H,21,22);1H
InChIKeyWSGVEKJHFKVPNF-UHFFFAOYSA-N
MW346.86 g/mol
LogP3.52
Rot. Bonds8

About 2-(cyclopropylmethylamino)-N-[(4-phenoxyphenyl)methyl]acetamide;hydrochloride

2-(cyclopropylmethylamino)-N-[(4-phenoxyphenyl)methyl]acetamide;hydrochloride (PubChem CID 119725146) has the molecular formula C19H23ClN2O2 and a molecular weight of 346.86 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-N-[(4-phenoxyphenyl)methyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-N-[(4-phenoxyphenyl)methyl]acetamide;hydrochloride
PubChem CID119725146
Molecular FormulaC19H23ClN2O2
Molecular Weight346.86 g/mol
Exact Mass346.14
IUPAC Name2-(cyclopropylmethylamino)-N-[(4-phenoxyphenyl)methyl]acetamide;hydrochloride
SMILESCl.O=C(CNCC1CC1)NCc1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C19H22N2O2.ClH/c22-19(14-20-12-15-6-7-15)21-13-16-8-10-18(11-9-16)23-17-4-2-1-3-5-17;/h1-5,8-11,15,20H,6-7,12-14H2,(H,21,22);1H
InChIKeyWSGVEKJHFKVPNF-UHFFFAOYSA-N
XLogP3.52
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.86
LogP ≤ 53.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 43298629
2-(cyclopropylmethylamino)-N-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]acetamide;hydrochloride
CID 119753123
2-(cyclopropylmethylamino)-N-[(2-phenoxyphenyl)methyl]acetamide
CID 119756337
N-[(4-chlorophenyl)methyl]-2-(cyclopropylmethylamino)acetamide
CID 54925408
2-(cyclopropylmethylamino)-N-[[4-(2-methoxyethoxy)phenyl]methyl]acetamide
CID 119723266
2-(cyclopropylmethylamino)-N-[(3-methoxyphenyl)methyl]acetamide;hydrochloride
CID 119678219
4-[[[2-(cyclopropylmethylamino)acetyl]amino]methyl]-N,N-dimethylbenzamide
CID 119701720
N-[(4-phenoxyphenyl)methyl]butanamide
CID 155214759
N-[4-[[[2-(cyclopropylmethylamino)acetyl]amino]methyl]phenyl]butanamide;hydrochloride
CID 119723609
ethyl 4-[[[2-(cyclopropylmethylamino)acetyl]amino]methyl]benzoate;hydrochloride
CID 119746512
3-[[[2-(cyclopropylmethylamino)acetyl]amino]methyl]benzoic acid
CID 61160544
N-[2-(benzylsulfamoyl)ethyl]-2-(cyclopropylmethylamino)acetamide;hydrochloride
CID 119723679

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-N-[(4-phenoxyphenyl)methyl]acetamide;hydrochloride?
The IUPAC name of 2-(cyclopropylmethylamino)-N-[(4-phenoxyphenyl)methyl]acetamide;hydrochloride (CID 119725146) is 2-(cyclopropylmethylamino)-N-[(4-phenoxyphenyl)methyl]acetamide;hydrochloride.
What is the SMILES notation for 2-(cyclopropylmethylamino)-N-[(4-phenoxyphenyl)methyl]acetamide;hydrochloride?
The canonical SMILES for 2-(cyclopropylmethylamino)-N-[(4-phenoxyphenyl)methyl]acetamide;hydrochloride is Cl.O=C(CNCC1CC1)NCc1ccc(Oc2ccccc2)cc1.
What is the InChIKey of 2-(cyclopropylmethylamino)-N-[(4-phenoxyphenyl)methyl]acetamide;hydrochloride?
The InChIKey is WSGVEKJHFKVPNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2.ClH/c22-19(14-20-12-15-6-7-15)21-13-16-8-10-18(11-9-16)23-17-4-2-1-3-5-17;/h1-5,8-11,15,20H,6-7,12-14H2,(H,21,22);1H.
What are the key properties of 2-(cyclopropylmethylamino)-N-[(4-phenoxyphenyl)methyl]acetamide;hydrochloride?
2-(cyclopropylmethylamino)-N-[(4-phenoxyphenyl)methyl]acetamide;hydrochloride has a molecular weight of 346.86 g/mol, XLogP of 3.52, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-N-[(4-phenoxyphenyl)methyl]acetamide;hydrochloride is sourced from PubChem (CID 119725146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).