N-[(4-methylpiperazin-1-yl)-piperidin-4-ylmethyl]formamide

C12H24N4O — CID 91272128

IUPACN-[(4-methylpiperazin-1-yl)-piperidin-4-ylmethyl]formamide
SMILESCN1CCN(C(NC=O)C2CCNCC2)CC1
InChIInChI=1S/C12H24N4O/c1-15-6-8-16(9-7-15)12(14-10-17)11-2-4-13-5-3-11/h10-13H,2-9H2,1H3,(H,14,17)
InChIKeyCGVWNMHEHKYJGC-UHFFFAOYSA-N
MW240.35 g/mol
LogP-0.69
Rot. Bonds4

About N-[(4-methylpiperazin-1-yl)-piperidin-4-ylmethyl]formamide

N-[(4-methylpiperazin-1-yl)-piperidin-4-ylmethyl]formamide (PubChem CID 91272128) has the molecular formula C12H24N4O and a molecular weight of 240.35 g/mol. Its IUPAC name is N-[(4-methylpiperazin-1-yl)-piperidin-4-ylmethyl]formamide.

Molecular Properties

Compound NameN-[(4-methylpiperazin-1-yl)-piperidin-4-ylmethyl]formamide
PubChem CID91272128
Molecular FormulaC12H24N4O
Molecular Weight240.35 g/mol
Exact Mass240.20
IUPAC NameN-[(4-methylpiperazin-1-yl)-piperidin-4-ylmethyl]formamide
SMILESCN1CCN(C(NC=O)C2CCNCC2)CC1
InChIInChI=1S/C12H24N4O/c1-15-6-8-16(9-7-15)12(14-10-17)11-2-4-13-5-3-11/h10-13H,2-9H2,1H3,(H,14,17)
InChIKeyCGVWNMHEHKYJGC-UHFFFAOYSA-N
XLogP-0.69
TPSA47.61 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 5-0.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

4-(1-methylpiperidin-4-yl)-N-(2-methylpropyl)piperazine-1-carboxamide
CID 172435138
2-Piperazin-1-ylpiperidine-1-carboxamide
CID 90952668
1-[3-(4-Methylpiperidin-1-yl)propyl]-1,3-diazinan-2-one
CID 44374263
N-methyl-2-[4-(4-methylpiperidine-1-carbonyl)piperazin-1-yl]acetamide
CID 128260021
Piperazin-1-yl-[4-(trifluoromethyl)piperidin-1-yl]methanone
CID 65533844
4-(Methylamino)-4-(4-methylpiperazin-1-yl)-3-(trifluoromethyl)piperidine-1-carbaldehyde
CID 151450971
4-methyl-N-(6-{[(4-methyl-1-piperidinyl)carbonyl]amino}hexyl)-1-piperidinecarboxamide
CID 307325
4-((2,4-dimethylpiperazin-1-yl)methyl)-N-isopropylpiperidine-1-carboxamide
CID 71784791
N-(tert-butyl)-4-((2,4-dimethylpiperazin-1-yl)methyl)piperidine-1-carboxamide
CID 71784792
4-Methylpiperidyl piperazinyl ketone
CID 16637244
(3-Amino-1-azabicyclo[2.2.2]octan-2-yl)urea
CID 22055147
1-(Piperidin-4-ylmethyl)-1,3-diazinan-2-one
CID 22573227

Frequently Asked Questions

What is the IUPAC name of N-[(4-methylpiperazin-1-yl)-piperidin-4-ylmethyl]formamide?
The IUPAC name of N-[(4-methylpiperazin-1-yl)-piperidin-4-ylmethyl]formamide (CID 91272128) is N-[(4-methylpiperazin-1-yl)-piperidin-4-ylmethyl]formamide.
What is the SMILES notation for N-[(4-methylpiperazin-1-yl)-piperidin-4-ylmethyl]formamide?
The canonical SMILES for N-[(4-methylpiperazin-1-yl)-piperidin-4-ylmethyl]formamide is CN1CCN(C(NC=O)C2CCNCC2)CC1.
What is the InChIKey of N-[(4-methylpiperazin-1-yl)-piperidin-4-ylmethyl]formamide?
The InChIKey is CGVWNMHEHKYJGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N4O/c1-15-6-8-16(9-7-15)12(14-10-17)11-2-4-13-5-3-11/h10-13H,2-9H2,1H3,(H,14,17).
What are the key properties of N-[(4-methylpiperazin-1-yl)-piperidin-4-ylmethyl]formamide?
N-[(4-methylpiperazin-1-yl)-piperidin-4-ylmethyl]formamide has a molecular weight of 240.35 g/mol, XLogP of -0.69, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methylpiperazin-1-yl)-piperidin-4-ylmethyl]formamide is sourced from PubChem (CID 91272128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).