2-(cyclopropylmethylamino)-N-[[2-(4-methoxyphenoxy)-4-pyridinyl]methyl]acetamide

C19H23N3O3 — CID 119847908

IUPAC2-(cyclopropylmethylamino)-N-[[2-(4-methoxyphenoxy)-4-pyridinyl]methyl]acetamide
SMILESCOc1ccc(Oc2cc(CNC(=O)CNCC3CC3)ccn2)cc1
InChIInChI=1S/C19H23N3O3/c1-24-16-4-6-17(7-5-16)25-19-10-15(8-9-21-19)12-22-18(23)13-20-11-14-2-3-14/h4-10,14,20H,2-3,11-13H2,1H3,(H,22,23)
InChIKeyNMSJKMSMYODQIZ-UHFFFAOYSA-N
MW341.41 g/mol
LogP2.50
Rot. Bonds9

About 2-(cyclopropylmethylamino)-N-[[2-(4-methoxyphenoxy)-4-pyridinyl]methyl]acetamide

2-(cyclopropylmethylamino)-N-[[2-(4-methoxyphenoxy)-4-pyridinyl]methyl]acetamide (PubChem CID 119847908) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-N-[[2-(4-methoxyphenoxy)-4-pyridinyl]methyl]acetamide.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-N-[[2-(4-methoxyphenoxy)-4-pyridinyl]methyl]acetamide
PubChem CID119847908
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC Name2-(cyclopropylmethylamino)-N-[[2-(4-methoxyphenoxy)-4-pyridinyl]methyl]acetamide
SMILESCOc1ccc(Oc2cc(CNC(=O)CNCC3CC3)ccn2)cc1
InChIInChI=1S/C19H23N3O3/c1-24-16-4-6-17(7-5-16)25-19-10-15(8-9-21-19)12-22-18(23)13-20-11-14-2-3-14/h4-10,14,20H,2-3,11-13H2,1H3,(H,22,23)
InChIKeyNMSJKMSMYODQIZ-UHFFFAOYSA-N
XLogP2.50
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[2-(4-methoxyphenoxy)-4-pyridinyl]methyl]hexanamide
CID 87005868
2-(cyclopropylmethylamino)-N-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]acetamide;hydrochloride
CID 119753123
2-cyclohexyl-N-[[2-(4-ethoxyphenoxy)-4-pyridinyl]methyl]acetamide
CID 55887691
2-(cyclopropylmethylamino)-N-[(3-methoxyphenyl)methyl]acetamide;hydrochloride
CID 119678219
N-[[2-(4-methoxyphenoxy)-4-pyridinyl]methyl]piperidine-2-carboxamide
CID 119847892
2-cyclopentyl-N-[(2-methoxy-4-pyridinyl)methyl]acetamide
CID 18167308
N-[[2-(4-ethoxyphenoxy)-4-pyridinyl]methyl]-2-(methylamino)acetamide;hydrochloride
CID 120703944
2-(4-methoxyphenoxy)-N-[(2-methoxy-4-pyridinyl)methyl]acetamide
CID 47019682
N-[2-[[2-(4-fluorophenoxy)-4-pyridinyl]methylamino]-2-oxoethyl]propanamide
CID 51104118
N-[(2-methoxy-4-pyridinyl)methyl]-2-(propylamino)acetamide
CID 62995403
3-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]propanamide
CID 18167253
4-(methoxymethyl)-N-[[2-(4-methoxyphenoxy)-4-pyridinyl]methyl]piperidine-4-carboxamide;dihydrochloride
CID 120641960

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-N-[[2-(4-methoxyphenoxy)-4-pyridinyl]methyl]acetamide?
The IUPAC name of 2-(cyclopropylmethylamino)-N-[[2-(4-methoxyphenoxy)-4-pyridinyl]methyl]acetamide (CID 119847908) is 2-(cyclopropylmethylamino)-N-[[2-(4-methoxyphenoxy)-4-pyridinyl]methyl]acetamide.
What is the SMILES notation for 2-(cyclopropylmethylamino)-N-[[2-(4-methoxyphenoxy)-4-pyridinyl]methyl]acetamide?
The canonical SMILES for 2-(cyclopropylmethylamino)-N-[[2-(4-methoxyphenoxy)-4-pyridinyl]methyl]acetamide is COc1ccc(Oc2cc(CNC(=O)CNCC3CC3)ccn2)cc1.
What is the InChIKey of 2-(cyclopropylmethylamino)-N-[[2-(4-methoxyphenoxy)-4-pyridinyl]methyl]acetamide?
The InChIKey is NMSJKMSMYODQIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-24-16-4-6-17(7-5-16)25-19-10-15(8-9-21-19)12-22-18(23)13-20-11-14-2-3-14/h4-10,14,20H,2-3,11-13H2,1H3,(H,22,23).
What are the key properties of 2-(cyclopropylmethylamino)-N-[[2-(4-methoxyphenoxy)-4-pyridinyl]methyl]acetamide?
2-(cyclopropylmethylamino)-N-[[2-(4-methoxyphenoxy)-4-pyridinyl]methyl]acetamide has a molecular weight of 341.41 g/mol, XLogP of 2.50, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-N-[[2-(4-methoxyphenoxy)-4-pyridinyl]methyl]acetamide is sourced from PubChem (CID 119847908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).