3-[[(3-hydroxycyclopentyl)methylamino]methyl]benzamide

C14H20N2O2 — CID 103270759

IUPAC3-[[(3-hydroxycyclopentyl)methylamino]methyl]benzamide
SMILESNC(=O)c1cccc(CNCC2CCC(O)C2)c1
InChIInChI=1S/C14H20N2O2/c15-14(18)12-3-1-2-10(6-12)8-16-9-11-4-5-13(17)7-11/h1-3,6,11,13,16-17H,4-5,7-9H2,(H2,15,18)
InChIKeyNAZMBAYZQSHQEQ-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.04
Rot. Bonds5

About 3-[[(3-hydroxycyclopentyl)methylamino]methyl]benzamide

3-[[(3-hydroxycyclopentyl)methylamino]methyl]benzamide (PubChem CID 103270759) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 3-[[(3-hydroxycyclopentyl)methylamino]methyl]benzamide.

Molecular Properties

Compound Name3-[[(3-hydroxycyclopentyl)methylamino]methyl]benzamide
PubChem CID103270759
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name3-[[(3-hydroxycyclopentyl)methylamino]methyl]benzamide
SMILESNC(=O)c1cccc(CNCC2CCC(O)C2)c1
InChIInChI=1S/C14H20N2O2/c15-14(18)12-3-1-2-10(6-12)8-16-9-11-4-5-13(17)7-11/h1-3,6,11,13,16-17H,4-5,7-9H2,(H2,15,18)
InChIKeyNAZMBAYZQSHQEQ-UHFFFAOYSA-N
XLogP1.04
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[(3-hydroxycyclohexyl)methylamino]methyl]benzamide
CID 103699975
N'-hydroxy-3-[[(3-hydroxycyclopentyl)methylamino]methyl]benzenecarboximidamide
CID 106136286
3-[[(3-methylphenyl)methylamino]methyl]cyclopentan-1-ol
CID 103270659
3-[(thiolan-3-ylmethylamino)methyl]benzamide
CID 107131427
3-[[(1,1-dioxothiolan-3-yl)methylamino]methyl]benzamide
CID 55026135
3-[[(4-hydroxycyclohexyl)amino]methyl]benzamide
CID 62998980
3-[(piperidin-3-ylmethylamino)methyl]benzamide
CID 80553685
3-[[[3-(methoxymethyl)phenyl]methylamino]methyl]cyclopentan-1-ol
CID 103270675
3-[[(4-hydroxypyrrolidin-3-yl)methylamino]methyl]benzamide;hydrochloride
CID 120961894
3-[[[(2R,3R)-2-propan-2-yloxolan-3-yl]methylamino]methyl]benzamide
CID 128993203
3-[[[(2S)-4-methylmorpholin-2-yl]methylamino]methyl]benzamide
CID 95329722
3-[(1,4-dithian-2-ylmethylamino)methyl]benzamide
CID 115696182

Frequently Asked Questions

What is the IUPAC name of 3-[[(3-hydroxycyclopentyl)methylamino]methyl]benzamide?
The IUPAC name of 3-[[(3-hydroxycyclopentyl)methylamino]methyl]benzamide (CID 103270759) is 3-[[(3-hydroxycyclopentyl)methylamino]methyl]benzamide.
What is the SMILES notation for 3-[[(3-hydroxycyclopentyl)methylamino]methyl]benzamide?
The canonical SMILES for 3-[[(3-hydroxycyclopentyl)methylamino]methyl]benzamide is NC(=O)c1cccc(CNCC2CCC(O)C2)c1.
What is the InChIKey of 3-[[(3-hydroxycyclopentyl)methylamino]methyl]benzamide?
The InChIKey is NAZMBAYZQSHQEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c15-14(18)12-3-1-2-10(6-12)8-16-9-11-4-5-13(17)7-11/h1-3,6,11,13,16-17H,4-5,7-9H2,(H2,15,18).
What are the key properties of 3-[[(3-hydroxycyclopentyl)methylamino]methyl]benzamide?
3-[[(3-hydroxycyclopentyl)methylamino]methyl]benzamide has a molecular weight of 248.33 g/mol, XLogP of 1.04, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(3-hydroxycyclopentyl)methylamino]methyl]benzamide is sourced from PubChem (CID 103270759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).