2-[(5-cyano-2-pyridinyl)-methylamino]-N-[(1-phenylcyclopropyl)methyl]acetamide

C19H20N4O — CID 56818310

IUPAC2-[(5-cyano-2-pyridinyl)-methylamino]-N-[(1-phenylcyclopropyl)methyl]acetamide
SMILESCN(CC(=O)NCC1(c2ccccc2)CC1)c1ccc(C#N)cn1
InChIInChI=1S/C19H20N4O/c1-23(17-8-7-15(11-20)12-21-17)13-18(24)22-14-19(9-10-19)16-5-3-2-4-6-16/h2-8,12H,9-10,13-14H2,1H3,(H,22,24)
InChIKeyJFOJMQRQMABLEQ-UHFFFAOYSA-N
MW320.40 g/mol
LogP2.24
Rot. Bonds6

About 2-[(5-cyano-2-pyridinyl)-methylamino]-N-[(1-phenylcyclopropyl)methyl]acetamide

2-[(5-cyano-2-pyridinyl)-methylamino]-N-[(1-phenylcyclopropyl)methyl]acetamide (PubChem CID 56818310) has the molecular formula C19H20N4O and a molecular weight of 320.40 g/mol. Its IUPAC name is 2-[(5-cyano-2-pyridinyl)-methylamino]-N-[(1-phenylcyclopropyl)methyl]acetamide.

Molecular Properties

Compound Name2-[(5-cyano-2-pyridinyl)-methylamino]-N-[(1-phenylcyclopropyl)methyl]acetamide
PubChem CID56818310
Molecular FormulaC19H20N4O
Molecular Weight320.40 g/mol
Exact Mass320.16
IUPAC Name2-[(5-cyano-2-pyridinyl)-methylamino]-N-[(1-phenylcyclopropyl)methyl]acetamide
SMILESCN(CC(=O)NCC1(c2ccccc2)CC1)c1ccc(C#N)cn1
InChIInChI=1S/C19H20N4O/c1-23(17-8-7-15(11-20)12-21-17)13-18(24)22-14-19(9-10-19)16-5-3-2-4-6-16/h2-8,12H,9-10,13-14H2,1H3,(H,22,24)
InChIKeyJFOJMQRQMABLEQ-UHFFFAOYSA-N
XLogP2.24
TPSA69.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.40
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-cyanopropyl(methyl)amino]-N-[(1-phenylcyclopropyl)methyl]acetamide
CID 47545886
3-[methyl-[2-oxo-2-[(1-phenylcyclopropyl)methylamino]ethyl]amino]propanoic acid
CID 119911689
2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-[(1-phenylcyclopropyl)methyl]acetamide
CID 34557487
2-[(5-cyano-2-pyridinyl)-methylamino]-N-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)acetamide
CID 102555556
2-(4-cyanophenoxy)-N-[(1-phenylcyclobutyl)methyl]acetamide
CID 17437937
2-[(5-cyano-2-pyridinyl)-methylamino]-N-[furan-2-yl(phenyl)methyl]acetamide
CID 71976556
2-[(5-cyano-2-pyridinyl)-methylamino]-N-(2-hydroxy-2-thiophen-3-ylethyl)acetamide
CID 71861276
2-[(5-cyano-2-pyridinyl)-methylamino]-N-(5-methyl-1,3-thiazol-2-yl)acetamide
CID 47359694
2-[(5-cyano-2-pyridinyl)-methylamino]-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
CID 47359932
2-amino-N-[(1-phenylcyclopropyl)methyl]acetamide
CID 110459326
6-[benzyl(methyl)amino]pyridine-3-carbonitrile
CID 24690148
3-oxo-N-[(1-phenylcyclopropyl)methyl]butanamide
CID 110470652

Frequently Asked Questions

What is the IUPAC name of 2-[(5-cyano-2-pyridinyl)-methylamino]-N-[(1-phenylcyclopropyl)methyl]acetamide?
The IUPAC name of 2-[(5-cyano-2-pyridinyl)-methylamino]-N-[(1-phenylcyclopropyl)methyl]acetamide (CID 56818310) is 2-[(5-cyano-2-pyridinyl)-methylamino]-N-[(1-phenylcyclopropyl)methyl]acetamide.
What is the SMILES notation for 2-[(5-cyano-2-pyridinyl)-methylamino]-N-[(1-phenylcyclopropyl)methyl]acetamide?
The canonical SMILES for 2-[(5-cyano-2-pyridinyl)-methylamino]-N-[(1-phenylcyclopropyl)methyl]acetamide is CN(CC(=O)NCC1(c2ccccc2)CC1)c1ccc(C#N)cn1.
What is the InChIKey of 2-[(5-cyano-2-pyridinyl)-methylamino]-N-[(1-phenylcyclopropyl)methyl]acetamide?
The InChIKey is JFOJMQRQMABLEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O/c1-23(17-8-7-15(11-20)12-21-17)13-18(24)22-14-19(9-10-19)16-5-3-2-4-6-16/h2-8,12H,9-10,13-14H2,1H3,(H,22,24).
What are the key properties of 2-[(5-cyano-2-pyridinyl)-methylamino]-N-[(1-phenylcyclopropyl)methyl]acetamide?
2-[(5-cyano-2-pyridinyl)-methylamino]-N-[(1-phenylcyclopropyl)methyl]acetamide has a molecular weight of 320.40 g/mol, XLogP of 2.24, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-cyano-2-pyridinyl)-methylamino]-N-[(1-phenylcyclopropyl)methyl]acetamide is sourced from PubChem (CID 56818310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).