N-[2-(hydroxymethyl)cyclohexyl]-2-methyl-2-piperazin-1-ylpropanamide

C15H29N3O2 — CID 106361497

IUPACN-[2-(hydroxymethyl)cyclohexyl]-2-methyl-2-piperazin-1-ylpropanamide
SMILESCC(C)(C(=O)NC1CCCCC1CO)N1CCNCC1
InChIInChI=1S/C15H29N3O2/c1-15(2,18-9-7-16-8-10-18)14(20)17-13-6-4-3-5-12(13)11-19/h12-13,16,19H,3-11H2,1-2H3,(H,17,20)
InChIKeyDAGHRTBZVKGZHD-UHFFFAOYSA-N
MW283.42 g/mol
LogP0.34
Rot. Bonds4

About N-[2-(hydroxymethyl)cyclohexyl]-2-methyl-2-piperazin-1-ylpropanamide

N-[2-(hydroxymethyl)cyclohexyl]-2-methyl-2-piperazin-1-ylpropanamide (PubChem CID 106361497) has the molecular formula C15H29N3O2 and a molecular weight of 283.42 g/mol. Its IUPAC name is N-[2-(hydroxymethyl)cyclohexyl]-2-methyl-2-piperazin-1-ylpropanamide.

Molecular Properties

Compound NameN-[2-(hydroxymethyl)cyclohexyl]-2-methyl-2-piperazin-1-ylpropanamide
PubChem CID106361497
Molecular FormulaC15H29N3O2
Molecular Weight283.42 g/mol
Exact Mass283.23
IUPAC NameN-[2-(hydroxymethyl)cyclohexyl]-2-methyl-2-piperazin-1-ylpropanamide
SMILESCC(C)(C(=O)NC1CCCCC1CO)N1CCNCC1
InChIInChI=1S/C15H29N3O2/c1-15(2,18-9-7-16-8-10-18)14(20)17-13-6-4-3-5-12(13)11-19/h12-13,16,19H,3-11H2,1-2H3,(H,17,20)
InChIKeyDAGHRTBZVKGZHD-UHFFFAOYSA-N
XLogP0.34
TPSA64.60 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 50.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-[2-(hydroxymethyl)cyclohexyl]-2-methyl-2-piperazin-1-ylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(6R)-1-(cyclohexylmethyl)-6-(1-hydroxyethyl)piperazine-2,3-dione
CID 16745912
N-(2-cyanopropyl)-2-[(1-cyclohexyl-3-hydroxypropyl)amino]-N-ethylacetamide
CID 75449423
(2S)-2-[ethyl(methyl)amino]-N-[1-(hydroxymethyl)cyclohexyl]butanamide
CID 164632719
N-[(3S)-1-hydroxy-4-methylpentan-3-yl]-2-methyl-2-piperidin-1-ylpropanamide
CID 164641472
N-[2-(hydroxymethyl)cyclohexyl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 103860255
2-[[2-(hydroxymethyl)cyclohexyl]amino]-N-(2,2,2-trifluoroethyl)acetamide
CID 104696254
2-[[2-(hydroxymethyl)cyclohexyl]amino]-N-(2,2,2-trifluoroethyl)propanamide
CID 106361092
2-amino-3,3,3-trifluoro-N-[2-(hydroxymethyl)cyclohexyl]-2-methylpropanamide
CID 114178740
1-(Cyclohexylmethyl)-6-(1-hydroxyethyl)piperazine-2,3-dione
CID 73319663
2-amino-N-[(2-hydroxycyclohexyl)methyl]-2-methylpropanamide
CID 21652806
2-amino-N-[4-(hydroxymethyl)cyclohexyl]-2-methylpropanamide
CID 21652814
2-amino-N-[[(1S,2R)-2-hydroxycyclohexyl]methyl]-2-methylpropanamide
CID 54187897

Frequently Asked Questions

What is the IUPAC name of N-[2-(hydroxymethyl)cyclohexyl]-2-methyl-2-piperazin-1-ylpropanamide?
The IUPAC name of N-[2-(hydroxymethyl)cyclohexyl]-2-methyl-2-piperazin-1-ylpropanamide (CID 106361497) is N-[2-(hydroxymethyl)cyclohexyl]-2-methyl-2-piperazin-1-ylpropanamide.
What is the SMILES notation for N-[2-(hydroxymethyl)cyclohexyl]-2-methyl-2-piperazin-1-ylpropanamide?
The canonical SMILES for N-[2-(hydroxymethyl)cyclohexyl]-2-methyl-2-piperazin-1-ylpropanamide is CC(C)(C(=O)NC1CCCCC1CO)N1CCNCC1.
What is the InChIKey of N-[2-(hydroxymethyl)cyclohexyl]-2-methyl-2-piperazin-1-ylpropanamide?
The InChIKey is DAGHRTBZVKGZHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O2/c1-15(2,18-9-7-16-8-10-18)14(20)17-13-6-4-3-5-12(13)11-19/h12-13,16,19H,3-11H2,1-2H3,(H,17,20).
What are the key properties of N-[2-(hydroxymethyl)cyclohexyl]-2-methyl-2-piperazin-1-ylpropanamide?
N-[2-(hydroxymethyl)cyclohexyl]-2-methyl-2-piperazin-1-ylpropanamide has a molecular weight of 283.42 g/mol, XLogP of 0.34, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(hydroxymethyl)cyclohexyl]-2-methyl-2-piperazin-1-ylpropanamide is sourced from PubChem (CID 106361497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).