3,3,5-trimethyl-2,4-dihydropyrrol-2-amine

C7H14N2 — CID 14638040

IUPAC3,3,5-trimethyl-2,4-dihydropyrrol-2-amine
SMILESCC1=NC(N)C(C)(C)C1
InChIInChI=1S/C7H14N2/c1-5-4-7(2,3)6(8)9-5/h6H,4,8H2,1-3H3
InChIKeyQLBNINVUXTWBLP-UHFFFAOYSA-N
MW126.20 g/mol
LogP1.16
Rot. Bonds

About 3,3,5-trimethyl-2,4-dihydropyrrol-2-amine

3,3,5-trimethyl-2,4-dihydropyrrol-2-amine (PubChem CID 14638040) has the molecular formula C7H14N2 and a molecular weight of 126.20 g/mol. Its IUPAC name is 3,3,5-trimethyl-2,4-dihydropyrrol-2-amine.

Molecular Properties

Compound Name3,3,5-trimethyl-2,4-dihydropyrrol-2-amine
PubChem CID14638040
Molecular FormulaC7H14N2
Molecular Weight126.20 g/mol
Exact Mass126.12
IUPAC Name3,3,5-trimethyl-2,4-dihydropyrrol-2-amine
SMILESCC1=NC(N)C(C)(C)C1
InChIInChI=1S/C7H14N2/c1-5-4-7(2,3)6(8)9-5/h6H,4,8H2,1-3H3
InChIKeyQLBNINVUXTWBLP-UHFFFAOYSA-N
XLogP1.16
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2H-Pyrrole, 3,4-dihydro-3,3,5-trimethyl-
CID 12141939
3,3,5-Trimethyl-2,4-dihydropyrrol-4-amine
CID 68070912
4-[(Butan-2-ylideneamino)methyl]-2,2,4-trimethylhexan-1-amine
CID 123412238
5-(Butan-2-ylideneamino)-2,2,4,4-tetramethylpentan-1-amine
CID 123484076
3-Imino-2,2-dimethylpentan-1-amine
CID 123675801
5-(Butan-2-ylideneamino)-2-ethyl-2,4,4-trimethylpentan-1-amine
CID 123713497
3,3,5-Trimethyl-1-oxido-2,4-dihydropyrrol-1-ium-2-amine
CID 78582580
3,5-dimethyl-3,4-dihydro-2H-pyrrol-2-amine
CID 143114957

Frequently Asked Questions

What is the IUPAC name of 3,3,5-trimethyl-2,4-dihydropyrrol-2-amine?
The IUPAC name of 3,3,5-trimethyl-2,4-dihydropyrrol-2-amine (CID 14638040) is 3,3,5-trimethyl-2,4-dihydropyrrol-2-amine.
What is the SMILES notation for 3,3,5-trimethyl-2,4-dihydropyrrol-2-amine?
The canonical SMILES for 3,3,5-trimethyl-2,4-dihydropyrrol-2-amine is CC1=NC(N)C(C)(C)C1.
What is the InChIKey of 3,3,5-trimethyl-2,4-dihydropyrrol-2-amine?
The InChIKey is QLBNINVUXTWBLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2/c1-5-4-7(2,3)6(8)9-5/h6H,4,8H2,1-3H3.
What are the key properties of 3,3,5-trimethyl-2,4-dihydropyrrol-2-amine?
3,3,5-trimethyl-2,4-dihydropyrrol-2-amine has a molecular weight of 126.20 g/mol, XLogP of 1.16, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,5-trimethyl-2,4-dihydropyrrol-2-amine is sourced from PubChem (CID 14638040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).