N-(3-amino-4-methylpentyl)-N-methyl-1H-pyrazole-5-carboxamide;hydrochloride

C11H21ClN4O — CID 119658630

IUPACN-(3-amino-4-methylpentyl)-N-methyl-1H-pyrazole-5-carboxamide;hydrochloride
SMILESCC(C)C(N)CCN(C)C(=O)c1ccn[nH]1.Cl
InChIInChI=1S/C11H20N4O.ClH/c1-8(2)9(12)5-7-15(3)11(16)10-4-6-13-14-10;/h4,6,8-9H,5,7,12H2,1-3H3,(H,13,14);1H
InChIKeyCDPOZFCADXANAY-UHFFFAOYSA-N
MW260.77 g/mol
LogP1.28
Rot. Bonds5

About N-(3-amino-4-methylpentyl)-N-methyl-1H-pyrazole-5-carboxamide;hydrochloride

N-(3-amino-4-methylpentyl)-N-methyl-1H-pyrazole-5-carboxamide;hydrochloride (PubChem CID 119658630) has the molecular formula C11H21ClN4O and a molecular weight of 260.77 g/mol. Its IUPAC name is N-(3-amino-4-methylpentyl)-N-methyl-1H-pyrazole-5-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(3-amino-4-methylpentyl)-N-methyl-1H-pyrazole-5-carboxamide;hydrochloride
PubChem CID119658630
Molecular FormulaC11H21ClN4O
Molecular Weight260.77 g/mol
Exact Mass260.14
IUPAC NameN-(3-amino-4-methylpentyl)-N-methyl-1H-pyrazole-5-carboxamide;hydrochloride
SMILESCC(C)C(N)CCN(C)C(=O)c1ccn[nH]1.Cl
InChIInChI=1S/C11H20N4O.ClH/c1-8(2)9(12)5-7-15(3)11(16)10-4-6-13-14-10;/h4,6,8-9H,5,7,12H2,1-3H3,(H,13,14);1H
InChIKeyCDPOZFCADXANAY-UHFFFAOYSA-N
XLogP1.28
TPSA75.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.77
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 119657391
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N-ethyl-N-methyl-1H-pyrazole-5-carboxamide
CID 70181889
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N-(3-amino-4-methylpentyl)-5-tert-butyl-N-methyl-1H-pyrazole-3-carboxamide;hydrochloride
CID 119660642
N-(3-amino-4-methylpentyl)-4-fluoro-N-methylbenzamide
CID 81484690
N-(4-aminobutan-2-yl)-N-methyl-1H-pyrazole-5-carboxamide
CID 63225607
N-(3-amino-4-methylpentyl)-N-methyl-6-oxo-1H-pyrazine-3-carboxamide
CID 115317414
4-amino-N-(3-amino-4-methylpentyl)-N-methylbenzamide
CID 122080936
N-(3-amino-4-methylpentyl)-4-ethyl-N-methylbenzamide;hydrochloride
CID 119657274
N-(3-amino-4-methylpentyl)-5-(4-methoxyphenyl)-N-methyl-1H-pyrazole-4-carboxamide;hydrochloride
CID 119658474
N-(3-amino-4-methylpentyl)-N-methyl-1H-indazole-3-carboxamide
CID 81484244

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-methylpentyl)-N-methyl-1H-pyrazole-5-carboxamide;hydrochloride?
The IUPAC name of N-(3-amino-4-methylpentyl)-N-methyl-1H-pyrazole-5-carboxamide;hydrochloride (CID 119658630) is N-(3-amino-4-methylpentyl)-N-methyl-1H-pyrazole-5-carboxamide;hydrochloride.
What is the SMILES notation for N-(3-amino-4-methylpentyl)-N-methyl-1H-pyrazole-5-carboxamide;hydrochloride?
The canonical SMILES for N-(3-amino-4-methylpentyl)-N-methyl-1H-pyrazole-5-carboxamide;hydrochloride is CC(C)C(N)CCN(C)C(=O)c1ccn[nH]1.Cl.
What is the InChIKey of N-(3-amino-4-methylpentyl)-N-methyl-1H-pyrazole-5-carboxamide;hydrochloride?
The InChIKey is CDPOZFCADXANAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O.ClH/c1-8(2)9(12)5-7-15(3)11(16)10-4-6-13-14-10;/h4,6,8-9H,5,7,12H2,1-3H3,(H,13,14);1H.
What are the key properties of N-(3-amino-4-methylpentyl)-N-methyl-1H-pyrazole-5-carboxamide;hydrochloride?
N-(3-amino-4-methylpentyl)-N-methyl-1H-pyrazole-5-carboxamide;hydrochloride has a molecular weight of 260.77 g/mol, XLogP of 1.28, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-methylpentyl)-N-methyl-1H-pyrazole-5-carboxamide;hydrochloride is sourced from PubChem (CID 119658630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).