2-(cyclopropylmethylamino)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]acetamide

C17H22N4O2 — CID 119858982

IUPAC2-(cyclopropylmethylamino)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]acetamide
SMILESCn1ccnc1COc1ccc(NC(=O)CNCC2CC2)cc1
InChIInChI=1S/C17H22N4O2/c1-21-9-8-19-16(21)12-23-15-6-4-14(5-7-15)20-17(22)11-18-10-13-2-3-13/h4-9,13,18H,2-3,10-12H2,1H3,(H,20,22)
InChIKeyOGANRJHNDJINTJ-UHFFFAOYSA-N
MW314.39 g/mol
LogP1.94
Rot. Bonds8

About 2-(cyclopropylmethylamino)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]acetamide

2-(cyclopropylmethylamino)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]acetamide (PubChem CID 119858982) has the molecular formula C17H22N4O2 and a molecular weight of 314.39 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]acetamide.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]acetamide
PubChem CID119858982
Molecular FormulaC17H22N4O2
Molecular Weight314.39 g/mol
Exact Mass314.17
IUPAC Name2-(cyclopropylmethylamino)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]acetamide
SMILESCn1ccnc1COc1ccc(NC(=O)CNCC2CC2)cc1
InChIInChI=1S/C17H22N4O2/c1-21-9-8-19-16(21)12-23-15-6-4-14(5-7-15)20-17(22)11-18-10-13-2-3-13/h4-9,13,18H,2-3,10-12H2,1H3,(H,20,22)
InChIKeyOGANRJHNDJINTJ-UHFFFAOYSA-N
XLogP1.94
TPSA68.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.39
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(cyclopropylmethylamino)-N-[4-(1-methylimidazol-2-yl)sulfanylphenyl]acetamide
CID 119699001
(3R)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]-1,1-dioxothiolane-3-carboxamide
CID 94518565
2-(4-butylphenyl)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]acetamide
CID 55767360
2-(cyclopropylmethylamino)-N-(4-propoxyphenyl)acetamide
CID 55060300
1-amino-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]cyclopropane-1-carboxamide;dihydrochloride
CID 119858947
2-(cyclopropylmethylamino)-N-(4-phenylmethoxyphenyl)acetamide;hydrochloride
CID 119669315
1-(4-chlorophenyl)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]cyclobutane-1-carboxamide
CID 55882122
1-acetyl-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]pyrrolidine-2-carboxamide
CID 86998698
2,2-dichloro-1-methyl-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]cyclopropane-1-carboxamide
CID 47045605
2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]acetamide
CID 60521657
N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]-3-(2,2,2-trifluoroethoxy)propanamide
CID 55881355
N-[4-(carbamoylamino)phenyl]-4-[(1-methylimidazol-2-yl)methoxy]benzamide
CID 55793990

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]acetamide?
The IUPAC name of 2-(cyclopropylmethylamino)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]acetamide (CID 119858982) is 2-(cyclopropylmethylamino)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]acetamide.
What is the SMILES notation for 2-(cyclopropylmethylamino)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]acetamide?
The canonical SMILES for 2-(cyclopropylmethylamino)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]acetamide is Cn1ccnc1COc1ccc(NC(=O)CNCC2CC2)cc1.
What is the InChIKey of 2-(cyclopropylmethylamino)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]acetamide?
The InChIKey is OGANRJHNDJINTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O2/c1-21-9-8-19-16(21)12-23-15-6-4-14(5-7-15)20-17(22)11-18-10-13-2-3-13/h4-9,13,18H,2-3,10-12H2,1H3,(H,20,22).
What are the key properties of 2-(cyclopropylmethylamino)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]acetamide?
2-(cyclopropylmethylamino)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]acetamide has a molecular weight of 314.39 g/mol, XLogP of 1.94, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]acetamide is sourced from PubChem (CID 119858982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).