N-(2-cyclopentyl-2-methylpropyl)-N'-methyl-2-propan-2-ylpropane-1,3-diamine

C16H34N2 — CID 115252969

IUPACN-(2-cyclopentyl-2-methylpropyl)-N'-methyl-2-propan-2-ylpropane-1,3-diamine
SMILESCNCC(CNCC(C)(C)C1CCCC1)C(C)C
InChIInChI=1S/C16H34N2/c1-13(2)14(10-17-5)11-18-12-16(3,4)15-8-6-7-9-15/h13-15,17-18H,6-12H2,1-5H3
InChIKeyHDYUWWUMHNHREK-UHFFFAOYSA-N
MW254.46 g/mol
LogP3.28
Rot. Bonds8

About N-(2-cyclopentyl-2-methylpropyl)-N'-methyl-2-propan-2-ylpropane-1,3-diamine

N-(2-cyclopentyl-2-methylpropyl)-N'-methyl-2-propan-2-ylpropane-1,3-diamine (PubChem CID 115252969) has the molecular formula C16H34N2 and a molecular weight of 254.46 g/mol. Its IUPAC name is N-(2-cyclopentyl-2-methylpropyl)-N'-methyl-2-propan-2-ylpropane-1,3-diamine.

Molecular Properties

Compound NameN-(2-cyclopentyl-2-methylpropyl)-N'-methyl-2-propan-2-ylpropane-1,3-diamine
PubChem CID115252969
Molecular FormulaC16H34N2
Molecular Weight254.46 g/mol
Exact Mass254.27
IUPAC NameN-(2-cyclopentyl-2-methylpropyl)-N'-methyl-2-propan-2-ylpropane-1,3-diamine
SMILESCNCC(CNCC(C)(C)C1CCCC1)C(C)C
InChIInChI=1S/C16H34N2/c1-13(2)14(10-17-5)11-18-12-16(3,4)15-8-6-7-9-15/h13-15,17-18H,6-12H2,1-5H3
InChIKeyHDYUWWUMHNHREK-UHFFFAOYSA-N
XLogP3.28
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.46
LogP ≤ 53.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-cyclopentyl-2-methylpropyl)-2-ethyl-N'-methylpropane-1,3-diamine
CID 115255240
N'-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,3-diamine
CID 115198967
3-methyl-2-[[[2-methyl-2-(oxan-4-yl)propyl]amino]methyl]butan-1-ol
CID 115252302
N'-(2-cyclopentyl-2-methylpropyl)-2,2-dimethylpropane-1,3-diamine
CID 115200319
1-N-(2-cyclopentyl-2-methylpropyl)-2-methylpropane-1,2-diamine
CID 115136380
2-(cyclopentylmethyl)-N,3-dimethylbutan-1-amine
CID 62529539
2,3,3-trimethyl-N-(2-methyl-2-piperidin-3-ylpropyl)butan-1-amine
CID 83200092
2-cyclobutyl-N-(hydrazinylmethyl)-2-methylpropan-1-amine
CID 115261517
2-[(2-cyclohexyl-2-methylpropyl)amino]ethanol
CID 115216597
2-[(2-cyclohexyl-2-methylpropyl)amino]acetaldehyde
CID 115223611
2-cyclopentyl-N-(1-cyclopropylethyl)-2-methylpropan-1-amine
CID 115895845
1-[(2-cyclobutyl-2-methylpropyl)amino]propan-2-one
CID 115235348

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentyl-2-methylpropyl)-N'-methyl-2-propan-2-ylpropane-1,3-diamine?
The IUPAC name of N-(2-cyclopentyl-2-methylpropyl)-N'-methyl-2-propan-2-ylpropane-1,3-diamine (CID 115252969) is N-(2-cyclopentyl-2-methylpropyl)-N'-methyl-2-propan-2-ylpropane-1,3-diamine.
What is the SMILES notation for N-(2-cyclopentyl-2-methylpropyl)-N'-methyl-2-propan-2-ylpropane-1,3-diamine?
The canonical SMILES for N-(2-cyclopentyl-2-methylpropyl)-N'-methyl-2-propan-2-ylpropane-1,3-diamine is CNCC(CNCC(C)(C)C1CCCC1)C(C)C.
What is the InChIKey of N-(2-cyclopentyl-2-methylpropyl)-N'-methyl-2-propan-2-ylpropane-1,3-diamine?
The InChIKey is HDYUWWUMHNHREK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2/c1-13(2)14(10-17-5)11-18-12-16(3,4)15-8-6-7-9-15/h13-15,17-18H,6-12H2,1-5H3.
What are the key properties of N-(2-cyclopentyl-2-methylpropyl)-N'-methyl-2-propan-2-ylpropane-1,3-diamine?
N-(2-cyclopentyl-2-methylpropyl)-N'-methyl-2-propan-2-ylpropane-1,3-diamine has a molecular weight of 254.46 g/mol, XLogP of 3.28, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentyl-2-methylpropyl)-N'-methyl-2-propan-2-ylpropane-1,3-diamine is sourced from PubChem (CID 115252969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).