N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-2-(4-methylpyrazol-1-yl)propanamide

C14H21N5O — CID 19534375

IUPACN-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-2-(4-methylpyrazol-1-yl)propanamide
SMILESCCn1cc(CNC(=O)C(C)n2cc(C)cn2)c(C)n1
InChIInChI=1S/C14H21N5O/c1-5-18-9-13(11(3)17-18)7-15-14(20)12(4)19-8-10(2)6-16-19/h6,8-9,12H,5,7H2,1-4H3,(H,15,20)
InChIKeyBSDQVDHEKLVVRZ-UHFFFAOYSA-N
MW275.36 g/mol
LogP1.59
Rot. Bonds5

About N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-2-(4-methylpyrazol-1-yl)propanamide

N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-2-(4-methylpyrazol-1-yl)propanamide (PubChem CID 19534375) has the molecular formula C14H21N5O and a molecular weight of 275.36 g/mol. Its IUPAC name is N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-2-(4-methylpyrazol-1-yl)propanamide.

Molecular Properties

Compound NameN-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-2-(4-methylpyrazol-1-yl)propanamide
PubChem CID19534375
Molecular FormulaC14H21N5O
Molecular Weight275.36 g/mol
Exact Mass275.17
IUPAC NameN-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-2-(4-methylpyrazol-1-yl)propanamide
SMILESCCn1cc(CNC(=O)C(C)n2cc(C)cn2)c(C)n1
InChIInChI=1S/C14H21N5O/c1-5-18-9-13(11(3)17-18)7-15-14(20)12(4)19-8-10(2)6-16-19/h6,8-9,12H,5,7H2,1-4H3,(H,15,20)
InChIKeyBSDQVDHEKLVVRZ-UHFFFAOYSA-N
XLogP1.59
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[1-[(1-ethyl-3-methylpyrazol-4-yl)methylamino]-1-oxopropan-2-yl]pyrazole-3-carboxylic acid
CID 19624339
2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]propanamide
CID 19528489
N-(furan-2-ylmethyl)-2-(4-methylpyrazol-1-yl)propanamide
CID 19534412
2-(4-bromopyrazol-1-yl)-N-[(1,5-dimethylpyrazol-4-yl)methyl]propanamide
CID 19537511
(2R)-2-(4-methylpyrazol-1-yl)-N-[(1-propylimidazol-2-yl)methyl]propanamide
CID 125444459
2-(4-methylpyrazol-1-yl)pentan-3-one
CID 64867990
N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-2-methyl-3-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanamide
CID 19566415
N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-1-(1-propan-2-ylpyrazol-4-yl)methanamine;hydrochloride
CID 126966572
1-[1-[1-(1-ethyl-3-methylpyrazol-4-yl)ethylamino]-1-oxopropan-2-yl]pyrazole-4-carboxylic acid
CID 19622483
ethyl (2R)-2-(4-methylpyrazol-1-yl)propanoate
CID 7017156
N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-4-methoxybenzamide
CID 19288632
N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 19440629

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-2-(4-methylpyrazol-1-yl)propanamide?
The IUPAC name of N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-2-(4-methylpyrazol-1-yl)propanamide (CID 19534375) is N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-2-(4-methylpyrazol-1-yl)propanamide.
What is the SMILES notation for N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-2-(4-methylpyrazol-1-yl)propanamide?
The canonical SMILES for N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-2-(4-methylpyrazol-1-yl)propanamide is CCn1cc(CNC(=O)C(C)n2cc(C)cn2)c(C)n1.
What is the InChIKey of N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-2-(4-methylpyrazol-1-yl)propanamide?
The InChIKey is BSDQVDHEKLVVRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O/c1-5-18-9-13(11(3)17-18)7-15-14(20)12(4)19-8-10(2)6-16-19/h6,8-9,12H,5,7H2,1-4H3,(H,15,20).
What are the key properties of N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-2-(4-methylpyrazol-1-yl)propanamide?
N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-2-(4-methylpyrazol-1-yl)propanamide has a molecular weight of 275.36 g/mol, XLogP of 1.59, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-2-(4-methylpyrazol-1-yl)propanamide is sourced from PubChem (CID 19534375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).