(2S)-2-hydroxy-N-[[(2R)-pyrrolidin-2-yl]methyl]propanamide

C8H16N2O2 — CID 130985831

IUPAC(2S)-2-hydroxy-N-[[(2R)-pyrrolidin-2-yl]methyl]propanamide
SMILESC[C@H](O)C(=O)NC[C@H]1CCCN1
InChIInChI=1S/C8H16N2O2/c1-6(11)8(12)10-5-7-3-2-4-9-7/h6-7,9,11H,2-5H2,1H3,(H,10,12)/t6-,7+/m0/s1
InChIKeyPSCLVSHLIOZWNR-NKWVEPMBSA-N
MW172.23 g/mol
LogP-0.76
Rot. Bonds3

About (2S)-2-hydroxy-N-[[(2R)-pyrrolidin-2-yl]methyl]propanamide

(2S)-2-hydroxy-N-[[(2R)-pyrrolidin-2-yl]methyl]propanamide (PubChem CID 130985831) has the molecular formula C8H16N2O2 and a molecular weight of 172.23 g/mol. Its IUPAC name is (2S)-2-hydroxy-N-[[(2R)-pyrrolidin-2-yl]methyl]propanamide.

Molecular Properties

Compound Name(2S)-2-hydroxy-N-[[(2R)-pyrrolidin-2-yl]methyl]propanamide
PubChem CID130985831
Molecular FormulaC8H16N2O2
Molecular Weight172.23 g/mol
Exact Mass172.12
IUPAC Name(2S)-2-hydroxy-N-[[(2R)-pyrrolidin-2-yl]methyl]propanamide
SMILESC[C@H](O)C(=O)NC[C@H]1CCCN1
InChIInChI=1S/C8H16N2O2/c1-6(11)8(12)10-5-7-3-2-4-9-7/h6-7,9,11H,2-5H2,1H3,(H,10,12)/t6-,7+/m0/s1
InChIKeyPSCLVSHLIOZWNR-NKWVEPMBSA-N
XLogP-0.76
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 5-0.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-hydroxy-N-(pyrrolidin-2-ylmethyl)propanamide
CID 126992577
(2R)-2-amino-N-(pyrrolidin-2-ylmethyl)propanamide;hydrochloride
CID 130719126
2-propan-2-yloxy-N-(pyrrolidin-2-ylmethyl)acetamide
CID 112701289
3-ethyl-N-(pyrrolidin-2-ylmethyl)pentanamide;hydrochloride
CID 119511693
2-phenyl-N-(piperidin-2-ylmethyl)propanamide
CID 114028770
2-(cyclopentylmethyl)-N-(pyrrolidin-2-ylmethyl)butanamide
CID 119510207
2,2-dimethyl-N-(pyrrolidin-2-ylmethyl)propanamide
CID 62542506
2-(cyclopentylmethyl)-N-(pyrrolidin-2-ylmethyl)butanamide;hydrochloride
CID 119510206
2-chloro-N-(pyrrolidin-2-ylmethyl)acetamide
CID 71302527
N-(pyrrolidin-2-ylmethyl)but-2-ynamide
CID 107990230
2-methyl-N-[2-[(2-pyrrolidin-2-ylacetyl)amino]ethyl]propanamide
CID 61365863
3,3,3-trifluoro-N-(piperidin-2-ylmethyl)-2-(trifluoromethyl)propanamide
CID 103309459

Frequently Asked Questions

What is the IUPAC name of (2S)-2-hydroxy-N-[[(2R)-pyrrolidin-2-yl]methyl]propanamide?
The IUPAC name of (2S)-2-hydroxy-N-[[(2R)-pyrrolidin-2-yl]methyl]propanamide (CID 130985831) is (2S)-2-hydroxy-N-[[(2R)-pyrrolidin-2-yl]methyl]propanamide.
What is the SMILES notation for (2S)-2-hydroxy-N-[[(2R)-pyrrolidin-2-yl]methyl]propanamide?
The canonical SMILES for (2S)-2-hydroxy-N-[[(2R)-pyrrolidin-2-yl]methyl]propanamide is C[C@H](O)C(=O)NC[C@H]1CCCN1.
What is the InChIKey of (2S)-2-hydroxy-N-[[(2R)-pyrrolidin-2-yl]methyl]propanamide?
The InChIKey is PSCLVSHLIOZWNR-NKWVEPMBSA-N. The full InChI is InChI=1S/C8H16N2O2/c1-6(11)8(12)10-5-7-3-2-4-9-7/h6-7,9,11H,2-5H2,1H3,(H,10,12)/t6-,7+/m0/s1.
What are the key properties of (2S)-2-hydroxy-N-[[(2R)-pyrrolidin-2-yl]methyl]propanamide?
(2S)-2-hydroxy-N-[[(2R)-pyrrolidin-2-yl]methyl]propanamide has a molecular weight of 172.23 g/mol, XLogP of -0.76, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-hydroxy-N-[[(2R)-pyrrolidin-2-yl]methyl]propanamide is sourced from PubChem (CID 130985831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).