N,4-dimethyl-1-propan-2-yloxypent-4-en-2-amine

C10H21NO — CID 105162913

IUPACN,4-dimethyl-1-propan-2-yloxypent-4-en-2-amine
SMILESC=C(C)CC(COC(C)C)NC
InChIInChI=1S/C10H21NO/c1-8(2)6-10(11-5)7-12-9(3)4/h9-11H,1,6-7H2,2-5H3
InChIKeyGGRRVVUXTZWGBA-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.97
Rot. Bonds6

About N,4-dimethyl-1-propan-2-yloxypent-4-en-2-amine

N,4-dimethyl-1-propan-2-yloxypent-4-en-2-amine (PubChem CID 105162913) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is N,4-dimethyl-1-propan-2-yloxypent-4-en-2-amine.

Molecular Properties

Compound NameN,4-dimethyl-1-propan-2-yloxypent-4-en-2-amine
PubChem CID105162913
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC NameN,4-dimethyl-1-propan-2-yloxypent-4-en-2-amine
SMILESC=C(C)CC(COC(C)C)NC
InChIInChI=1S/C10H21NO/c1-8(2)6-10(11-5)7-12-9(3)4/h9-11H,1,6-7H2,2-5H3
InChIKeyGGRRVVUXTZWGBA-UHFFFAOYSA-N
XLogP1.97
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-(methylamino)-3-propan-2-yloxypropan-1-ol
CID 64803823
ethane;4-methyl-2-(methylamino)pent-4-en-1-ol
CID 142030684
N-methyl-1-propan-2-yloxypent-4-en-2-amine
CID 116660601
N,4-dimethyl-1-propan-2-ylsulfanylpent-4-en-2-amine
CID 79185838
1-cyclobutyl-N,4-dimethylpent-4-en-2-amine
CID 103169029
1,1,1-trifluoro-N,5-dimethylhex-5-en-3-amine
CID 79180164
N-methyl-1-propan-2-yloxyundecan-2-amine
CID 105013250
N-methyl-1-propan-2-yloxyhex-5-yn-2-amine
CID 105148994
1-methoxy-N,2,7-trimethyloct-7-en-4-amine
CID 105182739
N-methyl-1-propan-2-yloxyhept-6-yn-2-amine
CID 105179473
5-methyl-N-propan-2-ylhex-5-en-3-amine
CID 134490897
N,4,6-trimethylhept-6-en-2-amine
CID 79186326

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-1-propan-2-yloxypent-4-en-2-amine?
The IUPAC name of N,4-dimethyl-1-propan-2-yloxypent-4-en-2-amine (CID 105162913) is N,4-dimethyl-1-propan-2-yloxypent-4-en-2-amine.
What is the SMILES notation for N,4-dimethyl-1-propan-2-yloxypent-4-en-2-amine?
The canonical SMILES for N,4-dimethyl-1-propan-2-yloxypent-4-en-2-amine is C=C(C)CC(COC(C)C)NC.
What is the InChIKey of N,4-dimethyl-1-propan-2-yloxypent-4-en-2-amine?
The InChIKey is GGRRVVUXTZWGBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-8(2)6-10(11-5)7-12-9(3)4/h9-11H,1,6-7H2,2-5H3.
What are the key properties of N,4-dimethyl-1-propan-2-yloxypent-4-en-2-amine?
N,4-dimethyl-1-propan-2-yloxypent-4-en-2-amine has a molecular weight of 171.28 g/mol, XLogP of 1.97, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-1-propan-2-yloxypent-4-en-2-amine is sourced from PubChem (CID 105162913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).