(2R)-N-[(2S)-1-aminopropan-2-yl]pyrrolidine-2-carboxamide;hydrochloride

C8H18ClN3O — CID 130736371

IUPAC(2R)-N-[(2S)-1-aminopropan-2-yl]pyrrolidine-2-carboxamide;hydrochloride
SMILESC[C@@H](CN)NC(=O)[C@H]1CCCN1.Cl
InChIInChI=1S/C8H17N3O.ClH/c1-6(5-9)11-8(12)7-3-2-4-10-7;/h6-7,10H,2-5,9H2,1H3,(H,11,12);1H/t6-,7+;/m0./s1
InChIKeyFXRARYVDDVWVFJ-UOERWJHTSA-N
MW207.70 g/mol
LogP-0.38
Rot. Bonds3

About (2R)-N-[(2S)-1-aminopropan-2-yl]pyrrolidine-2-carboxamide;hydrochloride

(2R)-N-[(2S)-1-aminopropan-2-yl]pyrrolidine-2-carboxamide;hydrochloride (PubChem CID 130736371) has the molecular formula C8H18ClN3O and a molecular weight of 207.70 g/mol. Its IUPAC name is (2R)-N-[(2S)-1-aminopropan-2-yl]pyrrolidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name(2R)-N-[(2S)-1-aminopropan-2-yl]pyrrolidine-2-carboxamide;hydrochloride
PubChem CID130736371
Molecular FormulaC8H18ClN3O
Molecular Weight207.70 g/mol
Exact Mass207.11
IUPAC Name(2R)-N-[(2S)-1-aminopropan-2-yl]pyrrolidine-2-carboxamide;hydrochloride
SMILESC[C@@H](CN)NC(=O)[C@H]1CCCN1.Cl
InChIInChI=1S/C8H17N3O.ClH/c1-6(5-9)11-8(12)7-3-2-4-10-7;/h6-7,10H,2-5,9H2,1H3,(H,11,12);1H/t6-,7+;/m0./s1
InChIKeyFXRARYVDDVWVFJ-UOERWJHTSA-N
XLogP-0.38
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.70
LogP ≤ 5-0.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

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N-(5-methylhexan-2-yl)piperidine-2-carboxamide
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N-[(1R)-1-hydroxyethyl]pyrrolidine-2-carboxamide
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CID 119291009
(2S)-N-(4-hydroxybutan-2-yl)piperidine-2-carboxamide
CID 104914608
methyl 3-[[(2R)-piperidine-2-carbonyl]amino]butanoate;hydrochloride
CID 119695157
methyl 3-(piperidine-2-carbonylamino)butanoate;hydrochloride
CID 119274282
(2R)-N-(4-methylhexan-2-yl)piperidine-2-carboxamide;hydrochloride
CID 119789194
N-(5,5-dimethylhexan-2-yl)piperidine-2-carboxamide;hydrochloride
CID 119330827
N-[(2R)-1-aminopropan-2-yl]morpholine-3-carboxamide;hydrochloride
CID 130674305

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(2S)-1-aminopropan-2-yl]pyrrolidine-2-carboxamide;hydrochloride?
The IUPAC name of (2R)-N-[(2S)-1-aminopropan-2-yl]pyrrolidine-2-carboxamide;hydrochloride (CID 130736371) is (2R)-N-[(2S)-1-aminopropan-2-yl]pyrrolidine-2-carboxamide;hydrochloride.
What is the SMILES notation for (2R)-N-[(2S)-1-aminopropan-2-yl]pyrrolidine-2-carboxamide;hydrochloride?
The canonical SMILES for (2R)-N-[(2S)-1-aminopropan-2-yl]pyrrolidine-2-carboxamide;hydrochloride is C[C@@H](CN)NC(=O)[C@H]1CCCN1.Cl.
What is the InChIKey of (2R)-N-[(2S)-1-aminopropan-2-yl]pyrrolidine-2-carboxamide;hydrochloride?
The InChIKey is FXRARYVDDVWVFJ-UOERWJHTSA-N. The full InChI is InChI=1S/C8H17N3O.ClH/c1-6(5-9)11-8(12)7-3-2-4-10-7;/h6-7,10H,2-5,9H2,1H3,(H,11,12);1H/t6-,7+;/m0./s1.
What are the key properties of (2R)-N-[(2S)-1-aminopropan-2-yl]pyrrolidine-2-carboxamide;hydrochloride?
(2R)-N-[(2S)-1-aminopropan-2-yl]pyrrolidine-2-carboxamide;hydrochloride has a molecular weight of 207.70 g/mol, XLogP of -0.38, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(2S)-1-aminopropan-2-yl]pyrrolidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 130736371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).