(2R)-2-amino-N-[1-(2H-tetrazol-5-yl)ethyl]propanamide

C6H12N6O — CID 78977288

IUPAC(2R)-2-amino-N-[1-(2H-tetrazol-5-yl)ethyl]propanamide
SMILESCC(NC(=O)[C@@H](C)N)c1nn[nH]n1
InChIInChI=1S/C6H12N6O/c1-3(7)6(13)8-4(2)5-9-11-12-10-5/h3-4H,7H2,1-2H3,(H,8,13)(H,9,10,11,12)/t3-,4?/m1/s1
InChIKeyNZDWBBDOTFPPLI-SYPWQXSBSA-N
MW184.20 g/mol
LogP-1.28
Rot. Bonds3

About (2R)-2-amino-N-[1-(2H-tetrazol-5-yl)ethyl]propanamide

(2R)-2-amino-N-[1-(2H-tetrazol-5-yl)ethyl]propanamide (PubChem CID 78977288) has the molecular formula C6H12N6O and a molecular weight of 184.20 g/mol. Its IUPAC name is (2R)-2-amino-N-[1-(2H-tetrazol-5-yl)ethyl]propanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[1-(2H-tetrazol-5-yl)ethyl]propanamide
PubChem CID78977288
Molecular FormulaC6H12N6O
Molecular Weight184.20 g/mol
Exact Mass184.11
IUPAC Name(2R)-2-amino-N-[1-(2H-tetrazol-5-yl)ethyl]propanamide
SMILESCC(NC(=O)[C@@H](C)N)c1nn[nH]n1
InChIInChI=1S/C6H12N6O/c1-3(7)6(13)8-4(2)5-9-11-12-10-5/h3-4H,7H2,1-2H3,(H,8,13)(H,9,10,11,12)/t3-,4?/m1/s1
InChIKeyNZDWBBDOTFPPLI-SYPWQXSBSA-N
XLogP-1.28
TPSA109.58 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.20
LogP ≤ 5-1.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-2-amino-N-[1-(2H-tetrazol-5-yl)ethyl]pentanamide
CID 107569502
3,3-dimethyl-2-[1-(2H-tetrazol-5-yl)ethylcarbamoyl]butanoic acid
CID 116537012
5-amino-N-[1-(2H-tetrazol-5-yl)ethyl]hexanamide
CID 82851846
2,2,3,3-tetramethyl-N-[1-(2H-tetrazol-5-yl)ethyl]cyclopropane-1-carboxamide
CID 66477311
1-methyl-3-[1-(2H-tetrazol-5-yl)ethyl]thiourea
CID 116507980
1-cyclopropyl-3-[1-(2H-tetrazol-5-yl)ethyl]urea
CID 62700432
5-hydroxy-N-[1-(2H-tetrazol-5-yl)ethyl]pentanamide
CID 79209401
1-(N'-hydroxycarbamimidoyl)-N-[1-(2H-tetrazol-5-yl)ethyl]cyclopropane-1-carboxamide
CID 80597791
2-hydrazinyl-N-[1-(2H-tetrazol-5-yl)ethyl]benzamide
CID 62248741
(2S)-5-oxo-N-[(1S)-1-(2H-tetrazol-5-yl)ethyl]pyrrolidine-2-carboxamide
CID 155074064
N-[1-(2H-tetrazol-5-yl)ethyl]azepane-1-carboxamide
CID 79151677
N-[1-(2H-tetrazol-5-yl)ethyl]piperidine-1-carboxamide
CID 79155725

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[1-(2H-tetrazol-5-yl)ethyl]propanamide?
The IUPAC name of (2R)-2-amino-N-[1-(2H-tetrazol-5-yl)ethyl]propanamide (CID 78977288) is (2R)-2-amino-N-[1-(2H-tetrazol-5-yl)ethyl]propanamide.
What is the SMILES notation for (2R)-2-amino-N-[1-(2H-tetrazol-5-yl)ethyl]propanamide?
The canonical SMILES for (2R)-2-amino-N-[1-(2H-tetrazol-5-yl)ethyl]propanamide is CC(NC(=O)[C@@H](C)N)c1nn[nH]n1.
What is the InChIKey of (2R)-2-amino-N-[1-(2H-tetrazol-5-yl)ethyl]propanamide?
The InChIKey is NZDWBBDOTFPPLI-SYPWQXSBSA-N. The full InChI is InChI=1S/C6H12N6O/c1-3(7)6(13)8-4(2)5-9-11-12-10-5/h3-4H,7H2,1-2H3,(H,8,13)(H,9,10,11,12)/t3-,4?/m1/s1.
What are the key properties of (2R)-2-amino-N-[1-(2H-tetrazol-5-yl)ethyl]propanamide?
(2R)-2-amino-N-[1-(2H-tetrazol-5-yl)ethyl]propanamide has a molecular weight of 184.20 g/mol, XLogP of -1.28, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[1-(2H-tetrazol-5-yl)ethyl]propanamide is sourced from PubChem (CID 78977288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).