(5S)-1-(cyclohexylmethyl)-N,N,5-trimethyl-4,5-dihydroimidazol-2-amine

C13H25N3 — CID 25102560

IUPAC(5S)-1-(cyclohexylmethyl)-N,N,5-trimethyl-4,5-dihydroimidazol-2-amine
SMILESC[C@H]1CN=C(N(C)C)N1CC1CCCCC1
InChIInChI=1S/C13H25N3/c1-11-9-14-13(15(2)3)16(11)10-12-7-5-4-6-8-12/h11-12H,4-10H2,1-3H3/t11-/m0/s1
InChIKeyARYHWRIITUJJPL-NSHDSACASA-N
MW223.36 g/mol
LogP2.19
Rot. Bonds2

About (5S)-1-(cyclohexylmethyl)-N,N,5-trimethyl-4,5-dihydroimidazol-2-amine

(5S)-1-(cyclohexylmethyl)-N,N,5-trimethyl-4,5-dihydroimidazol-2-amine (PubChem CID 25102560) has the molecular formula C13H25N3 and a molecular weight of 223.36 g/mol. Its IUPAC name is (5S)-1-(cyclohexylmethyl)-N,N,5-trimethyl-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name(5S)-1-(cyclohexylmethyl)-N,N,5-trimethyl-4,5-dihydroimidazol-2-amine
PubChem CID25102560
Molecular FormulaC13H25N3
Molecular Weight223.36 g/mol
Exact Mass223.20
IUPAC Name(5S)-1-(cyclohexylmethyl)-N,N,5-trimethyl-4,5-dihydroimidazol-2-amine
SMILESC[C@H]1CN=C(N(C)C)N1CC1CCCCC1
InChIInChI=1S/C13H25N3/c1-11-9-14-13(15(2)3)16(11)10-12-7-5-4-6-8-12/h11-12H,4-10H2,1-3H3/t11-/m0/s1
InChIKeyARYHWRIITUJJPL-NSHDSACASA-N
XLogP2.19
TPSA18.84 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5S)-1-(cyclohexylmethyl)-N,N,5-trimethyl-4,5-dihydroimidazol-2-amine?
The IUPAC name of (5S)-1-(cyclohexylmethyl)-N,N,5-trimethyl-4,5-dihydroimidazol-2-amine (CID 25102560) is (5S)-1-(cyclohexylmethyl)-N,N,5-trimethyl-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for (5S)-1-(cyclohexylmethyl)-N,N,5-trimethyl-4,5-dihydroimidazol-2-amine?
The canonical SMILES for (5S)-1-(cyclohexylmethyl)-N,N,5-trimethyl-4,5-dihydroimidazol-2-amine is C[C@H]1CN=C(N(C)C)N1CC1CCCCC1.
What is the InChIKey of (5S)-1-(cyclohexylmethyl)-N,N,5-trimethyl-4,5-dihydroimidazol-2-amine?
The InChIKey is ARYHWRIITUJJPL-NSHDSACASA-N. The full InChI is InChI=1S/C13H25N3/c1-11-9-14-13(15(2)3)16(11)10-12-7-5-4-6-8-12/h11-12H,4-10H2,1-3H3/t11-/m0/s1.
What are the key properties of (5S)-1-(cyclohexylmethyl)-N,N,5-trimethyl-4,5-dihydroimidazol-2-amine?
(5S)-1-(cyclohexylmethyl)-N,N,5-trimethyl-4,5-dihydroimidazol-2-amine has a molecular weight of 223.36 g/mol, XLogP of 2.19, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-1-(cyclohexylmethyl)-N,N,5-trimethyl-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 25102560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).