N,4-dimethyl-2-propan-2-yloxypent-1-en-3-amine

C10H21NO — CID 123675374

IUPACN,4-dimethyl-2-propan-2-yloxypent-1-en-3-amine
SMILESC=C(OC(C)C)C(NC)C(C)C
InChIInChI=1S/C10H21NO/c1-7(2)10(11-6)9(5)12-8(3)4/h7-8,10-11H,5H2,1-4,6H3
InChIKeyWBEWURPIZRQBJE-UHFFFAOYSA-N
MW171.28 g/mol
LogP2.17
Rot. Bonds5

About N,4-dimethyl-2-propan-2-yloxypent-1-en-3-amine

N,4-dimethyl-2-propan-2-yloxypent-1-en-3-amine (PubChem CID 123675374) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is N,4-dimethyl-2-propan-2-yloxypent-1-en-3-amine.

Molecular Properties

Compound NameN,4-dimethyl-2-propan-2-yloxypent-1-en-3-amine
PubChem CID123675374
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC NameN,4-dimethyl-2-propan-2-yloxypent-1-en-3-amine
SMILESC=C(OC(C)C)C(NC)C(C)C
InChIInChI=1S/C10H21NO/c1-7(2)10(11-6)9(5)12-8(3)4/h7-8,10-11H,5H2,1-4,6H3
InChIKeyWBEWURPIZRQBJE-UHFFFAOYSA-N
XLogP2.17
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

3-methyl-2-methylidene-N-propan-2-yloxolan-3-amine
CID 10678460
2-ethenoxy-N-prop-2-enylpent-1-en-3-amine
CID 88757679
2-ethoxy-N-prop-2-enylpent-1-en-3-amine
CID 88758604
N-ethyl-2-methoxy-4-methylpent-1-en-3-amine
CID 89244092
N-methyl-3-propan-2-yloxybut-3-en-2-amine
CID 123473590
N,3-dimethyl-2-pentoxypent-1-en-3-amine
CID 123541775
2-Butoxy-4-methylpent-1-en-3-amine
CID 126663156
2-ethoxy-N-hex-1-en-2-yl-4-methylpent-1-en-3-amine
CID 129043449
ethane;N-ethyl-2-methoxy-4-methylpent-1-en-3-amine
CID 145468293
(3R)-N,5-dimethyl-2-propan-2-yloxyhex-1-en-3-amine
CID 145642012
N,5-dimethyl-2-propan-2-yloxyhex-1-en-3-amine
CID 147933934
4-Methyl-2-propoxypent-1-en-3-amine
CID 154671444

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-2-propan-2-yloxypent-1-en-3-amine?
The IUPAC name of N,4-dimethyl-2-propan-2-yloxypent-1-en-3-amine (CID 123675374) is N,4-dimethyl-2-propan-2-yloxypent-1-en-3-amine.
What is the SMILES notation for N,4-dimethyl-2-propan-2-yloxypent-1-en-3-amine?
The canonical SMILES for N,4-dimethyl-2-propan-2-yloxypent-1-en-3-amine is C=C(OC(C)C)C(NC)C(C)C.
What is the InChIKey of N,4-dimethyl-2-propan-2-yloxypent-1-en-3-amine?
The InChIKey is WBEWURPIZRQBJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-7(2)10(11-6)9(5)12-8(3)4/h7-8,10-11H,5H2,1-4,6H3.
What are the key properties of N,4-dimethyl-2-propan-2-yloxypent-1-en-3-amine?
N,4-dimethyl-2-propan-2-yloxypent-1-en-3-amine has a molecular weight of 171.28 g/mol, XLogP of 2.17, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-2-propan-2-yloxypent-1-en-3-amine is sourced from PubChem (CID 123675374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).