(1R)-2-ethyl-2-N,2-N-dimethyl-1-phenylbutane-1,2-diamine

C14H24N2 — CID 124511355

IUPAC(1R)-2-ethyl-2-N,2-N-dimethyl-1-phenylbutane-1,2-diamine
SMILESCCC(CC)([C@H](N)c1ccccc1)N(C)C
InChIInChI=1S/C14H24N2/c1-5-14(6-2,16(3)4)13(15)12-10-8-7-9-11-12/h7-11,13H,5-6,15H2,1-4H3/t13-/m1/s1
InChIKeyLVMRGZSNALJHLF-CYBMUJFWSA-N
MW220.36 g/mol
LogP2.81
Rot. Bonds5

About (1R)-2-ethyl-2-N,2-N-dimethyl-1-phenylbutane-1,2-diamine

(1R)-2-ethyl-2-N,2-N-dimethyl-1-phenylbutane-1,2-diamine (PubChem CID 124511355) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is (1R)-2-ethyl-2-N,2-N-dimethyl-1-phenylbutane-1,2-diamine.

Molecular Properties

Compound Name(1R)-2-ethyl-2-N,2-N-dimethyl-1-phenylbutane-1,2-diamine
PubChem CID124511355
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC Name(1R)-2-ethyl-2-N,2-N-dimethyl-1-phenylbutane-1,2-diamine
SMILESCCC(CC)([C@H](N)c1ccccc1)N(C)C
InChIInChI=1S/C14H24N2/c1-5-14(6-2,16(3)4)13(15)12-10-8-7-9-11-12/h7-11,13H,5-6,15H2,1-4H3/t13-/m1/s1
InChIKeyLVMRGZSNALJHLF-CYBMUJFWSA-N
XLogP2.81
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (1R)-2-ethyl-2-N,2-N-dimethyl-1-phenylbutane-1,2-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-ethyl-1-(4-fluorophenyl)-2-N,2-N-dimethylbutane-1,2-diamine
CID 79061366
3-ethyl-3-N,3-N-dimethyl-1-pyridin-4-ylpentane-2,3-diamine
CID 79062650
N'-(1-methoxypropan-2-yl)-N',2,2-trimethyl-1-phenylpropane-1,3-diamine
CID 55163332
2,2-dimethyl-1-phenylbutane-1,4-diamine
CID 116934434
2-(dimethylamino)-2-ethyl-1-naphthalen-2-ylbutan-1-ol
CID 79061565
1-(1-benzothiophen-3-yl)-3-ethyl-3-N,3-N-dimethylpentane-2,3-diamine
CID 79062515
2-ethyl-2-N,2-N-dimethyl-1-[4-(trifluoromethyl)-3-pyridinyl]butane-1,2-diamine
CID 102708312
2-ethyl-2-methoxy-1-(4-phenylphenyl)butan-1-amine
CID 116760612
3-methoxy-2,2-dimethyl-1-phenylpropan-1-amine
CID 121314723
(1S)-1-phenylpropan-1-amine;hydrochloride
CID 44542268
2-methoxy-2-methyl-1-phenylpropan-1-amine
CID 76606196
2,2-dimethyl-N',N'-bis(2-methylpropyl)-1-phenylpropane-1,3-diamine
CID 63493468

Frequently Asked Questions

What is the IUPAC name of (1R)-2-ethyl-2-N,2-N-dimethyl-1-phenylbutane-1,2-diamine?
The IUPAC name of (1R)-2-ethyl-2-N,2-N-dimethyl-1-phenylbutane-1,2-diamine (CID 124511355) is (1R)-2-ethyl-2-N,2-N-dimethyl-1-phenylbutane-1,2-diamine.
What is the SMILES notation for (1R)-2-ethyl-2-N,2-N-dimethyl-1-phenylbutane-1,2-diamine?
The canonical SMILES for (1R)-2-ethyl-2-N,2-N-dimethyl-1-phenylbutane-1,2-diamine is CCC(CC)([C@H](N)c1ccccc1)N(C)C.
What is the InChIKey of (1R)-2-ethyl-2-N,2-N-dimethyl-1-phenylbutane-1,2-diamine?
The InChIKey is LVMRGZSNALJHLF-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H24N2/c1-5-14(6-2,16(3)4)13(15)12-10-8-7-9-11-12/h7-11,13H,5-6,15H2,1-4H3/t13-/m1/s1.
What are the key properties of (1R)-2-ethyl-2-N,2-N-dimethyl-1-phenylbutane-1,2-diamine?
(1R)-2-ethyl-2-N,2-N-dimethyl-1-phenylbutane-1,2-diamine has a molecular weight of 220.36 g/mol, XLogP of 2.81, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2-ethyl-2-N,2-N-dimethyl-1-phenylbutane-1,2-diamine is sourced from PubChem (CID 124511355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).