N-(dimethylcarbamoyl)-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;hydrochloride

C12H25ClN4O2 — CID 3066979

IUPACN-(dimethylcarbamoyl)-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;hydrochloride
SMILESCC(C)N1CCN(C(=O)N(C)C(=O)N(C)C)CC1.Cl
InChIInChI=1S/C12H24N4O2.ClH/c1-10(2)15-6-8-16(9-7-15)12(18)14(5)11(17)13(3)4;/h10H,6-9H2,1-5H3;1H
InChIKeyBWOFDAVNSMPGEF-UHFFFAOYSA-N
MW292.81 g/mol
LogP1.17
Rot. Bonds1

About N-(dimethylcarbamoyl)-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;hydrochloride

N-(dimethylcarbamoyl)-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;hydrochloride (PubChem CID 3066979) has the molecular formula C12H25ClN4O2 and a molecular weight of 292.81 g/mol. Its IUPAC name is N-(dimethylcarbamoyl)-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(dimethylcarbamoyl)-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;hydrochloride
PubChem CID3066979
Molecular FormulaC12H25ClN4O2
Molecular Weight292.81 g/mol
Exact Mass292.17
IUPAC NameN-(dimethylcarbamoyl)-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;hydrochloride
SMILESCC(C)N1CCN(C(=O)N(C)C(=O)N(C)C)CC1.Cl
InChIInChI=1S/C12H24N4O2.ClH/c1-10(2)15-6-8-16(9-7-15)12(18)14(5)11(17)13(3)4;/h10H,6-9H2,1-5H3;1H
InChIKeyBWOFDAVNSMPGEF-UHFFFAOYSA-N
XLogP1.17
TPSA47.10 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.81
LogP ≤ 51.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(dimethylcarbamoyl)-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;hydrochloride?
The IUPAC name of N-(dimethylcarbamoyl)-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;hydrochloride (CID 3066979) is N-(dimethylcarbamoyl)-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;hydrochloride.
What is the SMILES notation for N-(dimethylcarbamoyl)-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;hydrochloride?
The canonical SMILES for N-(dimethylcarbamoyl)-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;hydrochloride is CC(C)N1CCN(C(=O)N(C)C(=O)N(C)C)CC1.Cl.
What is the InChIKey of N-(dimethylcarbamoyl)-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;hydrochloride?
The InChIKey is BWOFDAVNSMPGEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N4O2.ClH/c1-10(2)15-6-8-16(9-7-15)12(18)14(5)11(17)13(3)4;/h10H,6-9H2,1-5H3;1H.
What are the key properties of N-(dimethylcarbamoyl)-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;hydrochloride?
N-(dimethylcarbamoyl)-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;hydrochloride has a molecular weight of 292.81 g/mol, XLogP of 1.17, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dimethylcarbamoyl)-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;hydrochloride is sourced from PubChem (CID 3066979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).