N-[4-[(5-methyl-1H-pyrazol-4-yl)methylamino]phenyl]cyclopropanecarboxamide

C15H18N4O — CID 43663626

IUPACN-[4-[(5-methyl-1H-pyrazol-4-yl)methylamino]phenyl]cyclopropanecarboxamide
SMILESCc1[nH]ncc1CNc1ccc(NC(=O)C2CC2)cc1
InChIInChI=1S/C15H18N4O/c1-10-12(9-17-19-10)8-16-13-4-6-14(7-5-13)18-15(20)11-2-3-11/h4-7,9,11,16H,2-3,8H2,1H3,(H,17,19)(H,18,20)
InChIKeyVZDPUWVSUJYKJJ-UHFFFAOYSA-N
MW270.34 g/mol
LogP2.68
Rot. Bonds5

About N-[4-[(5-methyl-1H-pyrazol-4-yl)methylamino]phenyl]cyclopropanecarboxamide

N-[4-[(5-methyl-1H-pyrazol-4-yl)methylamino]phenyl]cyclopropanecarboxamide (PubChem CID 43663626) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is N-[4-[(5-methyl-1H-pyrazol-4-yl)methylamino]phenyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[4-[(5-methyl-1H-pyrazol-4-yl)methylamino]phenyl]cyclopropanecarboxamide
PubChem CID43663626
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC NameN-[4-[(5-methyl-1H-pyrazol-4-yl)methylamino]phenyl]cyclopropanecarboxamide
SMILESCc1[nH]ncc1CNc1ccc(NC(=O)C2CC2)cc1
InChIInChI=1S/C15H18N4O/c1-10-12(9-17-19-10)8-16-13-4-6-14(7-5-13)18-15(20)11-2-3-11/h4-7,9,11,16H,2-3,8H2,1H3,(H,17,19)(H,18,20)
InChIKeyVZDPUWVSUJYKJJ-UHFFFAOYSA-N
XLogP2.68
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 52.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[(5-methyl-1H-pyrazol-4-yl)methylamino]phenyl]cyclopropanecarboxamide
CID 43663572
tert-butyl N-[4-[(5-methyl-1H-pyrazol-4-yl)methylamino]phenyl]carbamate
CID 103818455
4-[(5-methyl-1H-pyrazol-4-yl)methylamino]benzamide
CID 43663501
N-methyl-4-[(5-methyl-1H-pyrazol-4-yl)methylamino]benzamide
CID 43683696
N-[(5-methyl-1H-pyrazol-4-yl)methyl]-4-piperidin-1-ylaniline
CID 43715681
N-[4-(pyridin-4-ylmethylamino)phenyl]cyclopropanecarboxamide
CID 28660347
N-[(5-methyl-1H-pyrazol-4-yl)methyl]-4-propan-2-yloxyaniline
CID 43663707
N-[(5-methyl-1H-pyrazol-4-yl)methyl]cyclopent-3-ene-1-carboxamide
CID 64766749
[4-[(5-methyl-1H-pyrazol-4-yl)methylamino]phenyl]methanesulfonamide
CID 43745275
4-(2-methoxyethoxy)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]aniline
CID 43734233
N-[4-[[4-(hydroxymethyl)phenyl]methylamino]phenyl]cyclopropanecarboxamide
CID 110006449
N-[6-[(2-methylphenyl)methylamino]-3-pyridinyl]cyclopropanecarboxamide
CID 113011542

Frequently Asked Questions

What is the IUPAC name of N-[4-[(5-methyl-1H-pyrazol-4-yl)methylamino]phenyl]cyclopropanecarboxamide?
The IUPAC name of N-[4-[(5-methyl-1H-pyrazol-4-yl)methylamino]phenyl]cyclopropanecarboxamide (CID 43663626) is N-[4-[(5-methyl-1H-pyrazol-4-yl)methylamino]phenyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[4-[(5-methyl-1H-pyrazol-4-yl)methylamino]phenyl]cyclopropanecarboxamide?
The canonical SMILES for N-[4-[(5-methyl-1H-pyrazol-4-yl)methylamino]phenyl]cyclopropanecarboxamide is Cc1[nH]ncc1CNc1ccc(NC(=O)C2CC2)cc1.
What is the InChIKey of N-[4-[(5-methyl-1H-pyrazol-4-yl)methylamino]phenyl]cyclopropanecarboxamide?
The InChIKey is VZDPUWVSUJYKJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c1-10-12(9-17-19-10)8-16-13-4-6-14(7-5-13)18-15(20)11-2-3-11/h4-7,9,11,16H,2-3,8H2,1H3,(H,17,19)(H,18,20).
What are the key properties of N-[4-[(5-methyl-1H-pyrazol-4-yl)methylamino]phenyl]cyclopropanecarboxamide?
N-[4-[(5-methyl-1H-pyrazol-4-yl)methylamino]phenyl]cyclopropanecarboxamide has a molecular weight of 270.34 g/mol, XLogP of 2.68, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(5-methyl-1H-pyrazol-4-yl)methylamino]phenyl]cyclopropanecarboxamide is sourced from PubChem (CID 43663626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).