N-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine

C9H18N2 — CID 163796013

IUPACN-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine
SMILESCNN1CC=C(C(C)C)CC1
InChIInChI=1S/C9H18N2/c1-8(2)9-4-6-11(10-3)7-5-9/h4,8,10H,5-7H2,1-3H3
InChIKeyNAVLQXRRAYMUAV-UHFFFAOYSA-N
MW154.26 g/mol
LogP1.41
Rot. Bonds2

About N-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine

N-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine (PubChem CID 163796013) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is N-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine.

Molecular Properties

Compound NameN-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine
PubChem CID163796013
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC NameN-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine
SMILESCNN1CC=C(C(C)C)CC1
InChIInChI=1S/C9H18N2/c1-8(2)9-4-6-11(10-3)7-5-9/h4,8,10H,5-7H2,1-3H3
InChIKeyNAVLQXRRAYMUAV-UHFFFAOYSA-N
XLogP1.41
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 51.41
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

1-[[(5R)-6-fluoro-5-methylcyclohexa-1,3-dien-1-yl]methyl]-1,2-dimethylhydrazine
CID 166651439
2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)propan-1-amine
CID 57040750
4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine
CID 89419044
4-ethyl-N-methyl-3,6-dihydro-2H-pyridin-1-amine
CID 123255221
1-[(Z,2E)-2-ethylidene-3-methylpent-3-enyl]-1-[(2E)-2-ethylidenepentyl]-2-[(2E)-2-propan-2-ylpenta-2,4-dienyl]hydrazine
CID 139542181
[4-[(2,2-Dimethylhydrazinyl)methyl]cyclohexen-1-yl]methanamine
CID 146175353
4-tert-butyl-N-methyl-3,6-dihydro-2H-pyridin-1-amine
CID 155635700
(4-Propyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)azanide
CID 164142116
(6R)-6-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine
CID 170600728
(Z)-3-[2-(2-ethylhydrazinyl)propan-2-yl]-N,N-dimethylpent-3-en-1-amine
CID 173987548
2-(1,2,3,6-Tetrahydropyridin-4-yl)propan-1-amine
CID 105428172
2-methyl-5-(5-methyl-3,6-dihydro-2H-pyridin-1-yl)pentan-1-amine
CID 106314809

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine?
The IUPAC name of N-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine (CID 163796013) is N-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine.
What is the SMILES notation for N-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine?
The canonical SMILES for N-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine is CNN1CC=C(C(C)C)CC1.
What is the InChIKey of N-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine?
The InChIKey is NAVLQXRRAYMUAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2/c1-8(2)9-4-6-11(10-3)7-5-9/h4,8,10H,5-7H2,1-3H3.
What are the key properties of N-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine?
N-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine has a molecular weight of 154.26 g/mol, XLogP of 1.41, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine is sourced from PubChem (CID 163796013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).