N-[(1-hydroxycyclopentyl)methyl]-N,5-dimethylpiperazine-2-carboxamide

C13H25N3O2 — CID 114949604

IUPACN-[(1-hydroxycyclopentyl)methyl]-N,5-dimethylpiperazine-2-carboxamide
SMILESCC1CNC(C(=O)N(C)CC2(O)CCCC2)CN1
InChIInChI=1S/C13H25N3O2/c1-10-7-15-11(8-14-10)12(17)16(2)9-13(18)5-3-4-6-13/h10-11,14-15,18H,3-9H2,1-2H3
InChIKeyHFHZDBHGHVGOSV-UHFFFAOYSA-N
MW255.36 g/mol
LogP-0.30
Rot. Bonds3

About N-[(1-hydroxycyclopentyl)methyl]-N,5-dimethylpiperazine-2-carboxamide

N-[(1-hydroxycyclopentyl)methyl]-N,5-dimethylpiperazine-2-carboxamide (PubChem CID 114949604) has the molecular formula C13H25N3O2 and a molecular weight of 255.36 g/mol. Its IUPAC name is N-[(1-hydroxycyclopentyl)methyl]-N,5-dimethylpiperazine-2-carboxamide.

Molecular Properties

Compound NameN-[(1-hydroxycyclopentyl)methyl]-N,5-dimethylpiperazine-2-carboxamide
PubChem CID114949604
Molecular FormulaC13H25N3O2
Molecular Weight255.36 g/mol
Exact Mass255.19
IUPAC NameN-[(1-hydroxycyclopentyl)methyl]-N,5-dimethylpiperazine-2-carboxamide
SMILESCC1CNC(C(=O)N(C)CC2(O)CCCC2)CN1
InChIInChI=1S/C13H25N3O2/c1-10-7-15-11(8-14-10)12(17)16(2)9-13(18)5-3-4-6-13/h10-11,14-15,18H,3-9H2,1-2H3
InChIKeyHFHZDBHGHVGOSV-UHFFFAOYSA-N
XLogP-0.30
TPSA64.60 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 5-0.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-hydroxy-N-[(1-hydroxycyclopentyl)methyl]-N-methylpyrrolidine-2-carboxamide
CID 114948997
N-[(1-hydroxycyclopentyl)methyl]-N,6-dimethylpiperidine-3-carboxamide
CID 114949603
N-(2-amino-2-oxoethyl)-N,5-dimethylpiperazine-2-carboxamide
CID 63103311
N-(2-hydroxy-2-methylpropyl)-N,5-dimethylpiperazine-2-carboxamide
CID 79377571
N-[(1-hydroxycyclopentyl)methyl]-N,3-dimethylpiperidine-2-carboxamide
CID 114949609
(2R)-N-[(1-hydroxycyclopentyl)methyl]-N-methyl-5-oxopyrrolidine-2-carboxamide
CID 103840269
N-[(1-hydroxycyclopentyl)methyl]-N,2-dimethylpiperidine-3-carboxamide
CID 114949608
4-ethyl-N-[(1-hydroxycyclopentyl)methyl]-N-methylpiperidine-2-carboxamide
CID 114948966
N-[(1-hydroxycyclopentyl)methyl]-N-methylpyrrolidine-3-carboxamide
CID 114948903
4-[(1-hydroxycyclopentyl)methyl-methylcarbamoyl]cyclohexane-1-carboxylic acid
CID 114951146
3-[(1-hydroxycyclopentyl)methyl-methylcarbamoyl]-2,2-dimethylcyclopropane-1-carboxylic acid
CID 114948610
2-amino-N-[(1-hydroxycyclopentyl)methyl]-N,6-dimethylcyclohexane-1-carboxamide
CID 114953757

Frequently Asked Questions

What is the IUPAC name of N-[(1-hydroxycyclopentyl)methyl]-N,5-dimethylpiperazine-2-carboxamide?
The IUPAC name of N-[(1-hydroxycyclopentyl)methyl]-N,5-dimethylpiperazine-2-carboxamide (CID 114949604) is N-[(1-hydroxycyclopentyl)methyl]-N,5-dimethylpiperazine-2-carboxamide.
What is the SMILES notation for N-[(1-hydroxycyclopentyl)methyl]-N,5-dimethylpiperazine-2-carboxamide?
The canonical SMILES for N-[(1-hydroxycyclopentyl)methyl]-N,5-dimethylpiperazine-2-carboxamide is CC1CNC(C(=O)N(C)CC2(O)CCCC2)CN1.
What is the InChIKey of N-[(1-hydroxycyclopentyl)methyl]-N,5-dimethylpiperazine-2-carboxamide?
The InChIKey is HFHZDBHGHVGOSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2/c1-10-7-15-11(8-14-10)12(17)16(2)9-13(18)5-3-4-6-13/h10-11,14-15,18H,3-9H2,1-2H3.
What are the key properties of N-[(1-hydroxycyclopentyl)methyl]-N,5-dimethylpiperazine-2-carboxamide?
N-[(1-hydroxycyclopentyl)methyl]-N,5-dimethylpiperazine-2-carboxamide has a molecular weight of 255.36 g/mol, XLogP of -0.30, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-hydroxycyclopentyl)methyl]-N,5-dimethylpiperazine-2-carboxamide is sourced from PubChem (CID 114949604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).