N-[1-(methoxymethyl)pyrazol-4-yl]-3-(3-methylpyrazol-1-yl)propanamide

C12H17N5O2 — CID 19559500

IUPACN-[1-(methoxymethyl)pyrazol-4-yl]-3-(3-methylpyrazol-1-yl)propanamide
SMILESCOCn1cc(NC(=O)CCn2ccc(C)n2)cn1
InChIInChI=1S/C12H17N5O2/c1-10-3-5-16(15-10)6-4-12(18)14-11-7-13-17(8-11)9-19-2/h3,5,7-8H,4,6,9H2,1-2H3,(H,14,18)
InChIKeySBLWFFDRQXPVRF-UHFFFAOYSA-N
MW263.30 g/mol
LogP1.02
Rot. Bonds6

About N-[1-(methoxymethyl)pyrazol-4-yl]-3-(3-methylpyrazol-1-yl)propanamide

N-[1-(methoxymethyl)pyrazol-4-yl]-3-(3-methylpyrazol-1-yl)propanamide (PubChem CID 19559500) has the molecular formula C12H17N5O2 and a molecular weight of 263.30 g/mol. Its IUPAC name is N-[1-(methoxymethyl)pyrazol-4-yl]-3-(3-methylpyrazol-1-yl)propanamide.

Molecular Properties

Compound NameN-[1-(methoxymethyl)pyrazol-4-yl]-3-(3-methylpyrazol-1-yl)propanamide
PubChem CID19559500
Molecular FormulaC12H17N5O2
Molecular Weight263.30 g/mol
Exact Mass263.14
IUPAC NameN-[1-(methoxymethyl)pyrazol-4-yl]-3-(3-methylpyrazol-1-yl)propanamide
SMILESCOCn1cc(NC(=O)CCn2ccc(C)n2)cn1
InChIInChI=1S/C12H17N5O2/c1-10-3-5-16(15-10)6-4-12(18)14-11-7-13-17(8-11)9-19-2/h3,5,7-8H,4,6,9H2,1-2H3,(H,14,18)
InChIKeySBLWFFDRQXPVRF-UHFFFAOYSA-N
XLogP1.02
TPSA73.97 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3-methoxypropyl)-3-(3-methylpyrazol-1-yl)propanamide
CID 19559507
1-[3-[[1-(ethoxymethyl)pyrazol-4-yl]amino]-3-oxopropyl]pyrazole-3-carboxylic acid
CID 19470809
N-[1-(methoxymethyl)pyrazol-4-yl]propanamide
CID 19411093
3-(3-methylpyrazol-1-yl)-N-[1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]propanamide
CID 19555897
1-ethyl-N-[1-(methoxymethyl)pyrazol-4-yl]pyrazole-3-carboxamide
CID 19262380
N-(4-fluorophenyl)-3-(3-methylpyrazol-1-yl)propanamide
CID 46339386
N-(2-methoxyethyl)-3-(3-methylpyrazol-1-yl)propanamide
CID 19555927
N-[1-(ethoxymethyl)pyrazol-4-yl]-3-(3-nitropyrazol-1-yl)propanamide
CID 19566063
N-(1,5-dimethylpyrazol-4-yl)-3-(3-methylpyrazol-1-yl)propanamide
CID 19555805
3-[4-[[1-(methoxymethyl)pyrazol-4-yl]carbamoyl]pyrazol-1-yl]propanoic acid
CID 19471366
3-(3-methylpyrazol-1-yl)-N-(2,3,4,5,6-pentafluorophenyl)propanamide
CID 19555789
N-(3-chloro-4-fluorophenyl)-3-(3-methylpyrazol-1-yl)propanamide
CID 46339411

Frequently Asked Questions

What is the IUPAC name of N-[1-(methoxymethyl)pyrazol-4-yl]-3-(3-methylpyrazol-1-yl)propanamide?
The IUPAC name of N-[1-(methoxymethyl)pyrazol-4-yl]-3-(3-methylpyrazol-1-yl)propanamide (CID 19559500) is N-[1-(methoxymethyl)pyrazol-4-yl]-3-(3-methylpyrazol-1-yl)propanamide.
What is the SMILES notation for N-[1-(methoxymethyl)pyrazol-4-yl]-3-(3-methylpyrazol-1-yl)propanamide?
The canonical SMILES for N-[1-(methoxymethyl)pyrazol-4-yl]-3-(3-methylpyrazol-1-yl)propanamide is COCn1cc(NC(=O)CCn2ccc(C)n2)cn1.
What is the InChIKey of N-[1-(methoxymethyl)pyrazol-4-yl]-3-(3-methylpyrazol-1-yl)propanamide?
The InChIKey is SBLWFFDRQXPVRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5O2/c1-10-3-5-16(15-10)6-4-12(18)14-11-7-13-17(8-11)9-19-2/h3,5,7-8H,4,6,9H2,1-2H3,(H,14,18).
What are the key properties of N-[1-(methoxymethyl)pyrazol-4-yl]-3-(3-methylpyrazol-1-yl)propanamide?
N-[1-(methoxymethyl)pyrazol-4-yl]-3-(3-methylpyrazol-1-yl)propanamide has a molecular weight of 263.30 g/mol, XLogP of 1.02, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(methoxymethyl)pyrazol-4-yl]-3-(3-methylpyrazol-1-yl)propanamide is sourced from PubChem (CID 19559500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).