N,4-dimethyl-N-[1-[4-(methylcarbamoyl)piperazin-1-yl]ethyl]piperazine-1-carboxamide

C15H30N6O2 — CID 143433014

IUPACN,4-dimethyl-N-[1-[4-(methylcarbamoyl)piperazin-1-yl]ethyl]piperazine-1-carboxamide
SMILESCNC(=O)N1CCN(C(C)N(C)C(=O)N2CCN(C)CC2)CC1
InChIInChI=1S/C15H30N6O2/c1-13(19-9-11-20(12-10-19)14(22)16-2)18(4)15(23)21-7-5-17(3)6-8-21/h13H,5-12H2,1-4H3,(H,16,22)
InChIKeyBINMYZCSMHSSHZ-UHFFFAOYSA-N
MW326.45 g/mol
LogP-0.41
Rot. Bonds2

About N,4-dimethyl-N-[1-[4-(methylcarbamoyl)piperazin-1-yl]ethyl]piperazine-1-carboxamide

N,4-dimethyl-N-[1-[4-(methylcarbamoyl)piperazin-1-yl]ethyl]piperazine-1-carboxamide (PubChem CID 143433014) has the molecular formula C15H30N6O2 and a molecular weight of 326.45 g/mol. Its IUPAC name is N,4-dimethyl-N-[1-[4-(methylcarbamoyl)piperazin-1-yl]ethyl]piperazine-1-carboxamide.

Molecular Properties

Compound NameN,4-dimethyl-N-[1-[4-(methylcarbamoyl)piperazin-1-yl]ethyl]piperazine-1-carboxamide
PubChem CID143433014
Molecular FormulaC15H30N6O2
Molecular Weight326.45 g/mol
Exact Mass326.24
IUPAC NameN,4-dimethyl-N-[1-[4-(methylcarbamoyl)piperazin-1-yl]ethyl]piperazine-1-carboxamide
SMILESCNC(=O)N1CCN(C(C)N(C)C(=O)N2CCN(C)CC2)CC1
InChIInChI=1S/C15H30N6O2/c1-13(19-9-11-20(12-10-19)14(22)16-2)18(4)15(23)21-7-5-17(3)6-8-21/h13H,5-12H2,1-4H3,(H,16,22)
InChIKeyBINMYZCSMHSSHZ-UHFFFAOYSA-N
XLogP-0.41
TPSA62.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.45
LogP ≤ 5-0.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 160870034
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CID 162766916
(2R)-2-(dimethylamino)-3-methyl-1-(4-methylpiperazin-1-yl)butan-1-one
CID 71000045
N-[2,6-di(propan-2-yl)phenyl]-4-methylpiperazine-1-carboxamide
CID 108988458
2-methyl-1-(4-methylpiperazin-1-yl)propan-1-one
CID 3485569
ethane;N-ethyl-4-methylpiperazine-1-carboxamide
CID 162757758
4-tert-butyl-N-methylpiperazine-1-carboxamide
CID 59788280
4-[(dimethylamino)methyl]-N-methylpiperidine-1-carboxamide
CID 115583877

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-N-[1-[4-(methylcarbamoyl)piperazin-1-yl]ethyl]piperazine-1-carboxamide?
The IUPAC name of N,4-dimethyl-N-[1-[4-(methylcarbamoyl)piperazin-1-yl]ethyl]piperazine-1-carboxamide (CID 143433014) is N,4-dimethyl-N-[1-[4-(methylcarbamoyl)piperazin-1-yl]ethyl]piperazine-1-carboxamide.
What is the SMILES notation for N,4-dimethyl-N-[1-[4-(methylcarbamoyl)piperazin-1-yl]ethyl]piperazine-1-carboxamide?
The canonical SMILES for N,4-dimethyl-N-[1-[4-(methylcarbamoyl)piperazin-1-yl]ethyl]piperazine-1-carboxamide is CNC(=O)N1CCN(C(C)N(C)C(=O)N2CCN(C)CC2)CC1.
What is the InChIKey of N,4-dimethyl-N-[1-[4-(methylcarbamoyl)piperazin-1-yl]ethyl]piperazine-1-carboxamide?
The InChIKey is BINMYZCSMHSSHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N6O2/c1-13(19-9-11-20(12-10-19)14(22)16-2)18(4)15(23)21-7-5-17(3)6-8-21/h13H,5-12H2,1-4H3,(H,16,22).
What are the key properties of N,4-dimethyl-N-[1-[4-(methylcarbamoyl)piperazin-1-yl]ethyl]piperazine-1-carboxamide?
N,4-dimethyl-N-[1-[4-(methylcarbamoyl)piperazin-1-yl]ethyl]piperazine-1-carboxamide has a molecular weight of 326.45 g/mol, XLogP of -0.41, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-N-[1-[4-(methylcarbamoyl)piperazin-1-yl]ethyl]piperazine-1-carboxamide is sourced from PubChem (CID 143433014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).