(2S)-2-(dimethylamino)-N-[(1-hydroxycyclopentyl)methyl]propanamide

C11H22N2O2 — CID 111840753

IUPAC(2S)-2-(dimethylamino)-N-[(1-hydroxycyclopentyl)methyl]propanamide
SMILESC[C@@H](C(=O)NCC1(O)CCCC1)N(C)C
InChIInChI=1S/C11H22N2O2/c1-9(13(2)3)10(14)12-8-11(15)6-4-5-7-11/h9,15H,4-8H2,1-3H3,(H,12,14)/t9-/m0/s1
InChIKeyQKYSAMZQVIQRGY-VIFPVBQESA-N
MW214.31 g/mol
LogP0.36
Rot. Bonds4

About (2S)-2-(dimethylamino)-N-[(1-hydroxycyclopentyl)methyl]propanamide

(2S)-2-(dimethylamino)-N-[(1-hydroxycyclopentyl)methyl]propanamide (PubChem CID 111840753) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is (2S)-2-(dimethylamino)-N-[(1-hydroxycyclopentyl)methyl]propanamide.

Molecular Properties

Compound Name(2S)-2-(dimethylamino)-N-[(1-hydroxycyclopentyl)methyl]propanamide
PubChem CID111840753
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name(2S)-2-(dimethylamino)-N-[(1-hydroxycyclopentyl)methyl]propanamide
SMILESC[C@@H](C(=O)NCC1(O)CCCC1)N(C)C
InChIInChI=1S/C11H22N2O2/c1-9(13(2)3)10(14)12-8-11(15)6-4-5-7-11/h9,15H,4-8H2,1-3H3,(H,12,14)/t9-/m0/s1
InChIKeyQKYSAMZQVIQRGY-VIFPVBQESA-N
XLogP0.36
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1-hydroxycyclohexyl)methyl]-2-methylpropanamide
CID 58767519
2-chloro-N-[(1-hydroxycyclopentyl)methyl]propanamide
CID 65105224
(2S)-2-amino-N-[(1-hydroxycyclohexyl)methyl]-3-methylbutanamide
CID 65106150
3-amino-N-[(1-hydroxycyclohexyl)methyl]-2-methylpropanamide
CID 65106819
N-[(1-hydroxycyclopentyl)methyl]-2-methylsulfonylpropanamide
CID 115626883
4-[(1-hydroxycyclohexyl)methylamino]-2,3-dimethyl-4-oxobutanoic acid
CID 103498630
2-ethoxy-N-[(1-hydroxycyclopentyl)methyl]propanamide
CID 111331443
2-amino-N-[(1-hydroxycyclopentyl)methyl]-3,3-dimethylbutanamide
CID 77210747
N-[(1-hydroxycyclohexyl)methyl]-4-methoxy-2-methylbutanamide
CID 111539886
2-amino-N-[(1-hydroxycycloheptyl)methyl]-3,3-dimethylbutanamide
CID 77056764
(2S)-2-(2,6-difluorophenyl)-2-(dimethylamino)-N-[(1-hydroxycyclohexyl)methyl]acetamide
CID 97060565
N-[(1-hydroxycyclopentyl)methyl]-3-methylpentanamide
CID 114875416

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(dimethylamino)-N-[(1-hydroxycyclopentyl)methyl]propanamide?
The IUPAC name of (2S)-2-(dimethylamino)-N-[(1-hydroxycyclopentyl)methyl]propanamide (CID 111840753) is (2S)-2-(dimethylamino)-N-[(1-hydroxycyclopentyl)methyl]propanamide.
What is the SMILES notation for (2S)-2-(dimethylamino)-N-[(1-hydroxycyclopentyl)methyl]propanamide?
The canonical SMILES for (2S)-2-(dimethylamino)-N-[(1-hydroxycyclopentyl)methyl]propanamide is C[C@@H](C(=O)NCC1(O)CCCC1)N(C)C.
What is the InChIKey of (2S)-2-(dimethylamino)-N-[(1-hydroxycyclopentyl)methyl]propanamide?
The InChIKey is QKYSAMZQVIQRGY-VIFPVBQESA-N. The full InChI is InChI=1S/C11H22N2O2/c1-9(13(2)3)10(14)12-8-11(15)6-4-5-7-11/h9,15H,4-8H2,1-3H3,(H,12,14)/t9-/m0/s1.
What are the key properties of (2S)-2-(dimethylamino)-N-[(1-hydroxycyclopentyl)methyl]propanamide?
(2S)-2-(dimethylamino)-N-[(1-hydroxycyclopentyl)methyl]propanamide has a molecular weight of 214.31 g/mol, XLogP of 0.36, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(dimethylamino)-N-[(1-hydroxycyclopentyl)methyl]propanamide is sourced from PubChem (CID 111840753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).