N-propan-2-yl-5-(4-propan-2-yloxyphenyl)pent-1-en-2-amine

C17H27NO — CID 170569416

IUPACN-propan-2-yl-5-(4-propan-2-yloxyphenyl)pent-1-en-2-amine
SMILESC=C(CCCc1ccc(OC(C)C)cc1)NC(C)C
InChIInChI=1S/C17H27NO/c1-13(2)18-15(5)7-6-8-16-9-11-17(12-10-16)19-14(3)4/h9-14,18H,5-8H2,1-4H3
InChIKeyAOYLQXUQTNXTBI-UHFFFAOYSA-N
MW261.41 g/mol
LogP4.31
Rot. Bonds8

About N-propan-2-yl-5-(4-propan-2-yloxyphenyl)pent-1-en-2-amine

N-propan-2-yl-5-(4-propan-2-yloxyphenyl)pent-1-en-2-amine (PubChem CID 170569416) has the molecular formula C17H27NO and a molecular weight of 261.41 g/mol. Its IUPAC name is N-propan-2-yl-5-(4-propan-2-yloxyphenyl)pent-1-en-2-amine.

Molecular Properties

Compound NameN-propan-2-yl-5-(4-propan-2-yloxyphenyl)pent-1-en-2-amine
PubChem CID170569416
Molecular FormulaC17H27NO
Molecular Weight261.41 g/mol
Exact Mass261.21
IUPAC NameN-propan-2-yl-5-(4-propan-2-yloxyphenyl)pent-1-en-2-amine
SMILESC=C(CCCc1ccc(OC(C)C)cc1)NC(C)C
InChIInChI=1S/C17H27NO/c1-13(2)18-15(5)7-6-8-16-9-11-17(12-10-16)19-14(3)4/h9-14,18H,5-8H2,1-4H3
InChIKeyAOYLQXUQTNXTBI-UHFFFAOYSA-N
XLogP4.31
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 170371171
copper;3-(4-propan-2-yloxyphenyl)propan-1-ol
CID 70633990
4-[4-(4-propan-2-yloxyphenyl)butanoylamino]butanoic acid
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4-(4-propan-2-yloxyphenyl)butan-2-one
CID 24710648
5-(4-propan-2-yloxyphenyl)pentan-1-amine
CID 54244328
3-(4-propan-2-yloxyphenyl)propanethioamide
CID 83932816
1-propan-2-yl-3-[(4-propan-2-yloxyphenyl)methyl]urea
CID 47216205
N-ethyl-5-(4-propan-2-yloxyphenyl)pentan-1-amine
CID 65300939
N-carbamoyl-3-(4-propan-2-yloxyphenyl)propanamide
CID 173014561
4-[2-[(4-propan-2-yloxyphenyl)methylamino]ethyl]phenol
CID 61236557
1-propan-2-yl-2-[(4-propan-2-yloxyphenyl)methyl]guanidine
CID 111045350
4-[[(4-propan-2-yloxyphenyl)methylamino]methyl]phenol
CID 115581451

Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-5-(4-propan-2-yloxyphenyl)pent-1-en-2-amine?
The IUPAC name of N-propan-2-yl-5-(4-propan-2-yloxyphenyl)pent-1-en-2-amine (CID 170569416) is N-propan-2-yl-5-(4-propan-2-yloxyphenyl)pent-1-en-2-amine.
What is the SMILES notation for N-propan-2-yl-5-(4-propan-2-yloxyphenyl)pent-1-en-2-amine?
The canonical SMILES for N-propan-2-yl-5-(4-propan-2-yloxyphenyl)pent-1-en-2-amine is C=C(CCCc1ccc(OC(C)C)cc1)NC(C)C.
What is the InChIKey of N-propan-2-yl-5-(4-propan-2-yloxyphenyl)pent-1-en-2-amine?
The InChIKey is AOYLQXUQTNXTBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO/c1-13(2)18-15(5)7-6-8-16-9-11-17(12-10-16)19-14(3)4/h9-14,18H,5-8H2,1-4H3.
What are the key properties of N-propan-2-yl-5-(4-propan-2-yloxyphenyl)pent-1-en-2-amine?
N-propan-2-yl-5-(4-propan-2-yloxyphenyl)pent-1-en-2-amine has a molecular weight of 261.41 g/mol, XLogP of 4.31, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-5-(4-propan-2-yloxyphenyl)pent-1-en-2-amine is sourced from PubChem (CID 170569416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).