N,N-dimethyl-3-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)propan-1-amine

C14H25N — CID 54063719

IUPACN,N-dimethyl-3-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)propan-1-amine
SMILESCC1=C(C)C(CCCN(C)C)C(C)=C1C
InChIInChI=1S/C14H25N/c1-10-11(2)13(4)14(12(10)3)8-7-9-15(5)6/h14H,7-9H2,1-6H3
InChIKeyMBMVWDXQKAKMCL-UHFFFAOYSA-N
MW207.36 g/mol
LogP3.63
Rot. Bonds4

About N,N-dimethyl-3-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)propan-1-amine

N,N-dimethyl-3-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)propan-1-amine (PubChem CID 54063719) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is N,N-dimethyl-3-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)propan-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-3-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)propan-1-amine
PubChem CID54063719
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC NameN,N-dimethyl-3-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)propan-1-amine
SMILESCC1=C(C)C(CCCN(C)C)C(C)=C1C
InChIInChI=1S/C14H25N/c1-10-11(2)13(4)14(12(10)3)8-7-9-15(5)6/h14H,7-9H2,1-6H3
InChIKeyMBMVWDXQKAKMCL-UHFFFAOYSA-N
XLogP3.63
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.36
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)propan-1-amine?
The IUPAC name of N,N-dimethyl-3-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)propan-1-amine (CID 54063719) is N,N-dimethyl-3-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)propan-1-amine.
What is the SMILES notation for N,N-dimethyl-3-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)propan-1-amine?
The canonical SMILES for N,N-dimethyl-3-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)propan-1-amine is CC1=C(C)C(CCCN(C)C)C(C)=C1C.
What is the InChIKey of N,N-dimethyl-3-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)propan-1-amine?
The InChIKey is MBMVWDXQKAKMCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N/c1-10-11(2)13(4)14(12(10)3)8-7-9-15(5)6/h14H,7-9H2,1-6H3.
What are the key properties of N,N-dimethyl-3-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)propan-1-amine?
N,N-dimethyl-3-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)propan-1-amine has a molecular weight of 207.36 g/mol, XLogP of 3.63, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)propan-1-amine is sourced from PubChem (CID 54063719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).