2-N-ethyl-1-N-(2-methylpropyl)-2-N-naphthalen-1-ylpropane-1,2-diamine

C19H28N2 — CID 63491689

IUPAC2-N-ethyl-1-N-(2-methylpropyl)-2-N-naphthalen-1-ylpropane-1,2-diamine
SMILESCCN(c1cccc2ccccc12)C(C)CNCC(C)C
InChIInChI=1S/C19H28N2/c1-5-21(16(4)14-20-13-15(2)3)19-12-8-10-17-9-6-7-11-18(17)19/h6-12,15-16,20H,5,13-14H2,1-4H3
InChIKeyFJWXIUAPWKYGKL-UHFFFAOYSA-N
MW284.45 g/mol
LogP4.30
Rot. Bonds7

About 2-N-ethyl-1-N-(2-methylpropyl)-2-N-naphthalen-1-ylpropane-1,2-diamine

2-N-ethyl-1-N-(2-methylpropyl)-2-N-naphthalen-1-ylpropane-1,2-diamine (PubChem CID 63491689) has the molecular formula C19H28N2 and a molecular weight of 284.45 g/mol. Its IUPAC name is 2-N-ethyl-1-N-(2-methylpropyl)-2-N-naphthalen-1-ylpropane-1,2-diamine.

Molecular Properties

Compound Name2-N-ethyl-1-N-(2-methylpropyl)-2-N-naphthalen-1-ylpropane-1,2-diamine
PubChem CID63491689
Molecular FormulaC19H28N2
Molecular Weight284.45 g/mol
Exact Mass284.23
IUPAC Name2-N-ethyl-1-N-(2-methylpropyl)-2-N-naphthalen-1-ylpropane-1,2-diamine
SMILESCCN(c1cccc2ccccc12)C(C)CNCC(C)C
InChIInChI=1S/C19H28N2/c1-5-21(16(4)14-20-13-15(2)3)19-12-8-10-17-9-6-7-11-18(17)19/h6-12,15-16,20H,5,13-14H2,1-4H3
InChIKeyFJWXIUAPWKYGKL-UHFFFAOYSA-N
XLogP4.30
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.45
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-N-ethyl-2-N-naphthalen-1-yl-1-N-propan-2-ylpropane-1,2-diamine
CID 62424029
N'-ethyl-N-(2-methylpropyl)-N'-naphthalen-1-ylpropane-1,3-diamine
CID 63467286
2-N-ethyl-3-methyl-2-N-naphthalen-1-ylpentane-1,2-diamine
CID 43312452
2-N-ethyl-2-N-naphthalen-1-yl-1-N-propylbutane-1,2-diamine
CID 63492049
3-N-ethyl-3-N-naphthalen-1-ylpentane-1,3-diamine
CID 43428349
N-ethyl-N-naphthalen-1-yl-1-thiophen-3-ylethane-1,2-diamine
CID 43184723
2-N-ethyl-4-methylsulfanyl-2-N-naphthalen-1-ylbutane-1,2-diamine
CID 60811790
1-ethyl-1-naphthalen-1-ylhydrazine
CID 55252593
N-ethyl-N-(2-methylpropyl)-2-[(2-methylpropylamino)methyl]aniline
CID 63551148
2-N,3-dimethyl-2-N-naphthalen-1-ylbutane-1,2-diamine
CID 115138094
(2S)-1-[ethyl(naphthalen-1-yl)amino]propan-2-ol
CID 103934919
N,N-bis(2-methylpropyl)-2-[(2-methylpropylamino)methyl]aniline
CID 63552275

Frequently Asked Questions

What is the IUPAC name of 2-N-ethyl-1-N-(2-methylpropyl)-2-N-naphthalen-1-ylpropane-1,2-diamine?
The IUPAC name of 2-N-ethyl-1-N-(2-methylpropyl)-2-N-naphthalen-1-ylpropane-1,2-diamine (CID 63491689) is 2-N-ethyl-1-N-(2-methylpropyl)-2-N-naphthalen-1-ylpropane-1,2-diamine.
What is the SMILES notation for 2-N-ethyl-1-N-(2-methylpropyl)-2-N-naphthalen-1-ylpropane-1,2-diamine?
The canonical SMILES for 2-N-ethyl-1-N-(2-methylpropyl)-2-N-naphthalen-1-ylpropane-1,2-diamine is CCN(c1cccc2ccccc12)C(C)CNCC(C)C.
What is the InChIKey of 2-N-ethyl-1-N-(2-methylpropyl)-2-N-naphthalen-1-ylpropane-1,2-diamine?
The InChIKey is FJWXIUAPWKYGKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2/c1-5-21(16(4)14-20-13-15(2)3)19-12-8-10-17-9-6-7-11-18(17)19/h6-12,15-16,20H,5,13-14H2,1-4H3.
What are the key properties of 2-N-ethyl-1-N-(2-methylpropyl)-2-N-naphthalen-1-ylpropane-1,2-diamine?
2-N-ethyl-1-N-(2-methylpropyl)-2-N-naphthalen-1-ylpropane-1,2-diamine has a molecular weight of 284.45 g/mol, XLogP of 4.30, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-ethyl-1-N-(2-methylpropyl)-2-N-naphthalen-1-ylpropane-1,2-diamine is sourced from PubChem (CID 63491689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).