(5S)-5-[(dimethylamino)methyl]-4,5-dihydro-1H-imidazol-2-amine

C6H14N4 — CID 172879943

IUPAC(5S)-5-[(dimethylamino)methyl]-4,5-dihydro-1H-imidazol-2-amine
SMILESCN(C)C[C@H]1CN=C(N)N1
InChIInChI=1S/C6H14N4/c1-10(2)4-5-3-8-6(7)9-5/h5H,3-4H2,1-2H3,(H3,7,8,9)/t5-/m1/s1
InChIKeyWBJMQDDJJVECTD-RXMQYKEDSA-N
MW142.21 g/mol
LogP-1.17
Rot. Bonds2

About (5S)-5-[(dimethylamino)methyl]-4,5-dihydro-1H-imidazol-2-amine

(5S)-5-[(dimethylamino)methyl]-4,5-dihydro-1H-imidazol-2-amine (PubChem CID 172879943) has the molecular formula C6H14N4 and a molecular weight of 142.21 g/mol. Its IUPAC name is (5S)-5-[(dimethylamino)methyl]-4,5-dihydro-1H-imidazol-2-amine.

Molecular Properties

Compound Name(5S)-5-[(dimethylamino)methyl]-4,5-dihydro-1H-imidazol-2-amine
PubChem CID172879943
Molecular FormulaC6H14N4
Molecular Weight142.21 g/mol
Exact Mass142.12
IUPAC Name(5S)-5-[(dimethylamino)methyl]-4,5-dihydro-1H-imidazol-2-amine
SMILESCN(C)C[C@H]1CN=C(N)N1
InChIInChI=1S/C6H14N4/c1-10(2)4-5-3-8-6(7)9-5/h5H,3-4H2,1-2H3,(H3,7,8,9)/t5-/m1/s1
InChIKeyWBJMQDDJJVECTD-RXMQYKEDSA-N
XLogP-1.17
TPSA53.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.21
LogP ≤ 5-1.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(4S)-4-(2-aminoethyl)-4,5-dihydro-1H-imidazol-2-amine;hydrobromide
CID 136184118
[(4-Methylimidazolidin-2-ylidene)amino]formonitrile
CID 55288238
(4R)-4-(2-aminoethyl)-4,5-dihydro-1H-imidazol-2-amine;hydrobromide
CID 136184119
(4S)-4-[2-(dimethylamino)ethyl]-4,5-dihydro-1H-imidazol-2-amine;hydrobromide
CID 136184127
5-methyl-4,5-dihydro-1H-imidazol-2-amine hydrobromide
CID 71758637
4,5-Dimethyl-4,5-dihydro-1H-imidazole
CID 12367425
(4S,5S)-4,5-dimethyl-4,5-dihydro-1H-imidazole
CID 55286834
(4R,5S)-4,5-dimethyl-4,5-dihydro-1H-imidazole
CID 68247811
2,5-Diamino-4,6-dihydropyrimidine
CID 129846021
5-Methyl-4,5-dihydro-1H-imidazol-2-amine
CID 12443805
(R)-5-(2-aminoethyl)-4,5-dihydro-1H-imidazol-2-amine dihydrobromide
CID 44571823
5-[(dimethylamino)methyl]-4,5-dihydro-1H-imidazol-2-amine
CID 14396516

Frequently Asked Questions

What is the IUPAC name of (5S)-5-[(dimethylamino)methyl]-4,5-dihydro-1H-imidazol-2-amine?
The IUPAC name of (5S)-5-[(dimethylamino)methyl]-4,5-dihydro-1H-imidazol-2-amine (CID 172879943) is (5S)-5-[(dimethylamino)methyl]-4,5-dihydro-1H-imidazol-2-amine.
What is the SMILES notation for (5S)-5-[(dimethylamino)methyl]-4,5-dihydro-1H-imidazol-2-amine?
The canonical SMILES for (5S)-5-[(dimethylamino)methyl]-4,5-dihydro-1H-imidazol-2-amine is CN(C)C[C@H]1CN=C(N)N1.
What is the InChIKey of (5S)-5-[(dimethylamino)methyl]-4,5-dihydro-1H-imidazol-2-amine?
The InChIKey is WBJMQDDJJVECTD-RXMQYKEDSA-N. The full InChI is InChI=1S/C6H14N4/c1-10(2)4-5-3-8-6(7)9-5/h5H,3-4H2,1-2H3,(H3,7,8,9)/t5-/m1/s1.
What are the key properties of (5S)-5-[(dimethylamino)methyl]-4,5-dihydro-1H-imidazol-2-amine?
(5S)-5-[(dimethylamino)methyl]-4,5-dihydro-1H-imidazol-2-amine has a molecular weight of 142.21 g/mol, XLogP of -1.17, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-[(dimethylamino)methyl]-4,5-dihydro-1H-imidazol-2-amine is sourced from PubChem (CID 172879943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).