3-amino-N-[1-(hydroxymethyl)cyclohexyl]propanamide

C10H20N2O2 — CID 62553033

IUPAC3-amino-N-[1-(hydroxymethyl)cyclohexyl]propanamide
SMILESNCCC(=O)NC1(CO)CCCCC1
InChIInChI=1S/C10H20N2O2/c11-7-4-9(14)12-10(8-13)5-2-1-3-6-10/h13H,1-8,11H2,(H,12,14)
InChIKeyMKNIUVLFTVNJHG-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.15
Rot. Bonds4

About 3-amino-N-[1-(hydroxymethyl)cyclohexyl]propanamide

3-amino-N-[1-(hydroxymethyl)cyclohexyl]propanamide (PubChem CID 62553033) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 3-amino-N-[1-(hydroxymethyl)cyclohexyl]propanamide.

Molecular Properties

Compound Name3-amino-N-[1-(hydroxymethyl)cyclohexyl]propanamide
PubChem CID62553033
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name3-amino-N-[1-(hydroxymethyl)cyclohexyl]propanamide
SMILESNCCC(=O)NC1(CO)CCCCC1
InChIInChI=1S/C10H20N2O2/c11-7-4-9(14)12-10(8-13)5-2-1-3-6-10/h13H,1-8,11H2,(H,12,14)
InChIKeyMKNIUVLFTVNJHG-UHFFFAOYSA-N
XLogP0.15
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

6-amino-N-[1-(hydroxymethyl)cyclohexyl]hexanamide
CID 55086608
3-cyclohexyl-N-[1-(hydroxymethyl)cyclohexyl]propanamide
CID 62519861
3-cyclohexyl-N-[1-(hydroxymethyl)cyclopentyl]propanamide
CID 62517314
1-(3-aminopropanoylamino)cyclohexane-1-carboxamide
CID 119296087
N-[1-(hydroxymethyl)cyclopentyl]-2-[1-(methylamino)cyclohexyl]acetamide
CID 65242231
N-[1-(hydroxymethyl)cyclopentyl]heptanamide
CID 62518617
3-amino-N-[1-(hydroxymethyl)cyclohexyl]butanamide
CID 62552043
5-amino-N-[1-(hydroxymethyl)cyclopentyl]hexanamide
CID 82851755
3-(4-chlorophenyl)sulfanyl-N-[1-(hydroxymethyl)cyclohexyl]propanamide
CID 62520950
3-(2-aminophenoxy)-N-[1-(hydroxymethyl)cyclopentyl]propanamide
CID 62523597
2-(2-aminophenyl)-N-[1-(hydroxymethyl)cyclohexyl]acetamide
CID 62526209
2-cyclohexyl-N-[1-(hydroxymethyl)cyclopentyl]acetamide
CID 62518543

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[1-(hydroxymethyl)cyclohexyl]propanamide?
The IUPAC name of 3-amino-N-[1-(hydroxymethyl)cyclohexyl]propanamide (CID 62553033) is 3-amino-N-[1-(hydroxymethyl)cyclohexyl]propanamide.
What is the SMILES notation for 3-amino-N-[1-(hydroxymethyl)cyclohexyl]propanamide?
The canonical SMILES for 3-amino-N-[1-(hydroxymethyl)cyclohexyl]propanamide is NCCC(=O)NC1(CO)CCCCC1.
What is the InChIKey of 3-amino-N-[1-(hydroxymethyl)cyclohexyl]propanamide?
The InChIKey is MKNIUVLFTVNJHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c11-7-4-9(14)12-10(8-13)5-2-1-3-6-10/h13H,1-8,11H2,(H,12,14).
What are the key properties of 3-amino-N-[1-(hydroxymethyl)cyclohexyl]propanamide?
3-amino-N-[1-(hydroxymethyl)cyclohexyl]propanamide has a molecular weight of 200.28 g/mol, XLogP of 0.15, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[1-(hydroxymethyl)cyclohexyl]propanamide is sourced from PubChem (CID 62553033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).