N-(1-cyclopropylethyl)-2-propan-2-ylaniline

C14H21N — CID 43192462

IUPACN-(1-cyclopropylethyl)-2-propan-2-ylaniline
SMILESCC(C)c1ccccc1NC(C)C1CC1
InChIInChI=1S/C14H21N/c1-10(2)13-6-4-5-7-14(13)15-11(3)12-8-9-12/h4-7,10-12,15H,8-9H2,1-3H3
InChIKeyYZWCOKKFVLHQJU-UHFFFAOYSA-N
MW203.33 g/mol
LogP4.02
Rot. Bonds4

About N-(1-cyclopropylethyl)-2-propan-2-ylaniline

N-(1-cyclopropylethyl)-2-propan-2-ylaniline (PubChem CID 43192462) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is N-(1-cyclopropylethyl)-2-propan-2-ylaniline.

Molecular Properties

Compound NameN-(1-cyclopropylethyl)-2-propan-2-ylaniline
PubChem CID43192462
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC NameN-(1-cyclopropylethyl)-2-propan-2-ylaniline
SMILESCC(C)c1ccccc1NC(C)C1CC1
InChIInChI=1S/C14H21N/c1-10(2)13-6-4-5-7-14(13)15-11(3)12-8-9-12/h4-7,10-12,15H,8-9H2,1-3H3
InChIKeyYZWCOKKFVLHQJU-UHFFFAOYSA-N
XLogP4.02
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(1-cyclohexylethyl)-2-propan-2-ylaniline
CID 43759431
N-[1-(1-methylpiperidin-4-yl)ethyl]-2-propan-2-ylaniline
CID 43307621
1-[2-[[(1R)-1-cyclopropylethyl]amino]phenyl]ethane-1,2-diol
CID 173469571
N-(1-cyclopropylethyl)-2-fluoroaniline
CID 43194895
2-propan-2-yl-N-(4-propan-2-ylcyclohexyl)aniline
CID 63419203
N-(1-cyclopropylethyl)-2,3-dimethylaniline
CID 43196438
N-(1-cyclopropylethyl)-2-(methoxymethyl)aniline
CID 43677996
2-(1-cyclopropylethylamino)benzenesulfonamide
CID 43533533
[2-(1-cyclopentylethylamino)phenyl]methanol
CID 62632467
3-chloro-N-(1-cyclopropylethyl)-2-methylaniline
CID 43192017
N-(1-cyclopropylethyl)-2-(methylsulfinylmethyl)aniline
CID 104695196
2-bromo-3-chloro-N-(1-cyclopropylethyl)aniline
CID 103477842

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylethyl)-2-propan-2-ylaniline?
The IUPAC name of N-(1-cyclopropylethyl)-2-propan-2-ylaniline (CID 43192462) is N-(1-cyclopropylethyl)-2-propan-2-ylaniline.
What is the SMILES notation for N-(1-cyclopropylethyl)-2-propan-2-ylaniline?
The canonical SMILES for N-(1-cyclopropylethyl)-2-propan-2-ylaniline is CC(C)c1ccccc1NC(C)C1CC1.
What is the InChIKey of N-(1-cyclopropylethyl)-2-propan-2-ylaniline?
The InChIKey is YZWCOKKFVLHQJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-10(2)13-6-4-5-7-14(13)15-11(3)12-8-9-12/h4-7,10-12,15H,8-9H2,1-3H3.
What are the key properties of N-(1-cyclopropylethyl)-2-propan-2-ylaniline?
N-(1-cyclopropylethyl)-2-propan-2-ylaniline has a molecular weight of 203.33 g/mol, XLogP of 4.02, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethyl)-2-propan-2-ylaniline is sourced from PubChem (CID 43192462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).