(2R)-2-amino-3-(diethylamino)propanamide

C7H17N3O — CID 94048632

IUPAC(2R)-2-amino-3-(diethylamino)propanamide
SMILESCCN(CC)C[C@@H](N)C(N)=O
InChIInChI=1S/C7H17N3O/c1-3-10(4-2)5-6(8)7(9)11/h6H,3-5,8H2,1-2H3,(H2,9,11)/t6-/m1/s1
InChIKeyNISPMVGHNDCVFW-ZCFIWIBFSA-N
MW159.23 g/mol
LogP-0.86
Rot. Bonds5

About (2R)-2-amino-3-(diethylamino)propanamide

(2R)-2-amino-3-(diethylamino)propanamide (PubChem CID 94048632) has the molecular formula C7H17N3O and a molecular weight of 159.23 g/mol. Its IUPAC name is (2R)-2-amino-3-(diethylamino)propanamide.

Molecular Properties

Compound Name(2R)-2-amino-3-(diethylamino)propanamide
PubChem CID94048632
Molecular FormulaC7H17N3O
Molecular Weight159.23 g/mol
Exact Mass159.14
IUPAC Name(2R)-2-amino-3-(diethylamino)propanamide
SMILESCCN(CC)C[C@@H](N)C(N)=O
InChIInChI=1S/C7H17N3O/c1-3-10(4-2)5-6(8)7(9)11/h6H,3-5,8H2,1-2H3,(H2,9,11)/t6-/m1/s1
InChIKeyNISPMVGHNDCVFW-ZCFIWIBFSA-N
XLogP-0.86
TPSA72.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 5-0.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-3-(diethylamino)propanoic acid
CID 45082341
4-amino-5-(diethylamino)pent-1-en-3-one
CID 88510307
2-aminobutanamide;hydrochloride
CID 14333659
2-amino-3-[3-(diethylamino)propyl-ethylamino]propanoic acid
CID 102994758
2-amino-4-[ethyl(2-methoxyethyl)amino]butanamide
CID 63054468
2-amino-3-(diethylamino)propan-1-ol
CID 57209208
sodium;(2S)-2-aminobutanamide;hydride;hydrochloride
CID 174916391
2-amino-4-(dibutylamino)butanamide
CID 63027628
(2R)-2-amino-N-[1-(diethylamino)propan-2-yl]pentanamide
CID 103814036
(3R)-3-amino-5-(diethylamino)pentan-2-one
CID 88995223
(2R)-1-N,1-N-diethylpropane-1,2-diamine;dihydrochloride
CID 137346902
methyl 2-amino-3-[cyclopropylmethyl(ethyl)amino]propanoate
CID 63955898

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-3-(diethylamino)propanamide?
The IUPAC name of (2R)-2-amino-3-(diethylamino)propanamide (CID 94048632) is (2R)-2-amino-3-(diethylamino)propanamide.
What is the SMILES notation for (2R)-2-amino-3-(diethylamino)propanamide?
The canonical SMILES for (2R)-2-amino-3-(diethylamino)propanamide is CCN(CC)C[C@@H](N)C(N)=O.
What is the InChIKey of (2R)-2-amino-3-(diethylamino)propanamide?
The InChIKey is NISPMVGHNDCVFW-ZCFIWIBFSA-N. The full InChI is InChI=1S/C7H17N3O/c1-3-10(4-2)5-6(8)7(9)11/h6H,3-5,8H2,1-2H3,(H2,9,11)/t6-/m1/s1.
What are the key properties of (2R)-2-amino-3-(diethylamino)propanamide?
(2R)-2-amino-3-(diethylamino)propanamide has a molecular weight of 159.23 g/mol, XLogP of -0.86, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-3-(diethylamino)propanamide is sourced from PubChem (CID 94048632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).