2-(cyclopropylmethylamino)-N-[4-(oxolan-3-yloxy)phenyl]acetamide;hydrochloride

C16H23ClN2O3 — CID 119798675

IUPAC2-(cyclopropylmethylamino)-N-[4-(oxolan-3-yloxy)phenyl]acetamide;hydrochloride
SMILESCl.O=C(CNCC1CC1)Nc1ccc(OC2CCOC2)cc1
InChIInChI=1S/C16H22N2O3.ClH/c19-16(10-17-9-12-1-2-12)18-13-3-5-14(6-4-13)21-15-7-8-20-11-15;/h3-6,12,15,17H,1-2,7-11H2,(H,18,19);1H
InChIKeyMMCXKYUXKORNRX-UHFFFAOYSA-N
MW326.82 g/mol
LogP2.21
Rot. Bonds7

About 2-(cyclopropylmethylamino)-N-[4-(oxolan-3-yloxy)phenyl]acetamide;hydrochloride

2-(cyclopropylmethylamino)-N-[4-(oxolan-3-yloxy)phenyl]acetamide;hydrochloride (PubChem CID 119798675) has the molecular formula C16H23ClN2O3 and a molecular weight of 326.82 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-N-[4-(oxolan-3-yloxy)phenyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-N-[4-(oxolan-3-yloxy)phenyl]acetamide;hydrochloride
PubChem CID119798675
Molecular FormulaC16H23ClN2O3
Molecular Weight326.82 g/mol
Exact Mass326.14
IUPAC Name2-(cyclopropylmethylamino)-N-[4-(oxolan-3-yloxy)phenyl]acetamide;hydrochloride
SMILESCl.O=C(CNCC1CC1)Nc1ccc(OC2CCOC2)cc1
InChIInChI=1S/C16H22N2O3.ClH/c19-16(10-17-9-12-1-2-12)18-13-3-5-14(6-4-13)21-15-7-8-20-11-15;/h3-6,12,15,17H,1-2,7-11H2,(H,18,19);1H
InChIKeyMMCXKYUXKORNRX-UHFFFAOYSA-N
XLogP2.21
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.82
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(cyclopropylmethylamino)-N-[4-(oxolan-3-yloxy)phenyl]acetamide;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

N-[4-(oxolan-3-yloxy)phenyl]-2-pyrrolidin-2-ylacetamide
CID 119798692
2-(cyclopropylmethylamino)-N-[4-(2-hydroxycyclohexyl)oxyphenyl]acetamide;hydrochloride
CID 119793780
N-[4-(oxolan-3-yloxy)phenyl]-2-thiomorpholin-3-ylacetamide
CID 119939664
2-amino-3-methoxy-N-[4-(oxolan-3-yloxy)phenyl]propanamide;hydrochloride
CID 120990540
2-(cyclopropylmethylamino)-N-(4-methylphenyl)acetamide
CID 28566911
N-[4-[[2-(cyclopropylmethylamino)acetyl]amino]phenyl]cyclopropanecarboxamide;hydrochloride
CID 119700150
(2S,5R)-5-(aminomethyl)-N-[4-(oxolan-3-yloxy)phenyl]oxolane-2-carboxamide;hydrochloride
CID 120794517
2-(cyclopropylmethylamino)-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 60842957
4-[[2-(cyclopropylmethylamino)acetyl]amino]benzamide;hydrochloride
CID 119672411
2-(cyclopropylmethylamino)-N-(4-propoxyphenyl)acetamide
CID 55060300
methyl N-[4-[[2-(cyclopropylmethylamino)acetyl]amino]phenyl]carbamate
CID 60866405
2-(cyclopropylmethylamino)-N-(4-phenylmethoxyphenyl)acetamide;hydrochloride
CID 119669315

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-N-[4-(oxolan-3-yloxy)phenyl]acetamide;hydrochloride?
The IUPAC name of 2-(cyclopropylmethylamino)-N-[4-(oxolan-3-yloxy)phenyl]acetamide;hydrochloride (CID 119798675) is 2-(cyclopropylmethylamino)-N-[4-(oxolan-3-yloxy)phenyl]acetamide;hydrochloride.
What is the SMILES notation for 2-(cyclopropylmethylamino)-N-[4-(oxolan-3-yloxy)phenyl]acetamide;hydrochloride?
The canonical SMILES for 2-(cyclopropylmethylamino)-N-[4-(oxolan-3-yloxy)phenyl]acetamide;hydrochloride is Cl.O=C(CNCC1CC1)Nc1ccc(OC2CCOC2)cc1.
What is the InChIKey of 2-(cyclopropylmethylamino)-N-[4-(oxolan-3-yloxy)phenyl]acetamide;hydrochloride?
The InChIKey is MMCXKYUXKORNRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O3.ClH/c19-16(10-17-9-12-1-2-12)18-13-3-5-14(6-4-13)21-15-7-8-20-11-15;/h3-6,12,15,17H,1-2,7-11H2,(H,18,19);1H.
What are the key properties of 2-(cyclopropylmethylamino)-N-[4-(oxolan-3-yloxy)phenyl]acetamide;hydrochloride?
2-(cyclopropylmethylamino)-N-[4-(oxolan-3-yloxy)phenyl]acetamide;hydrochloride has a molecular weight of 326.82 g/mol, XLogP of 2.21, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-N-[4-(oxolan-3-yloxy)phenyl]acetamide;hydrochloride is sourced from PubChem (CID 119798675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).