5-chloro-N-(2,2-dimethylpropyl)-N-methyl-6-[(propan-2-ylamino)methyl]pyridin-2-amine

C15H26ClN3 — CID 62288309

IUPAC5-chloro-N-(2,2-dimethylpropyl)-N-methyl-6-[(propan-2-ylamino)methyl]pyridin-2-amine
SMILESCC(C)NCc1nc(N(C)CC(C)(C)C)ccc1Cl
InChIInChI=1S/C15H26ClN3/c1-11(2)17-9-13-12(16)7-8-14(18-13)19(6)10-15(3,4)5/h7-8,11,17H,9-10H2,1-6H3
InChIKeyPOMXWGRMLLWKEY-UHFFFAOYSA-N
MW283.85 g/mol
LogP3.72
Rot. Bonds5

About 5-chloro-N-(2,2-dimethylpropyl)-N-methyl-6-[(propan-2-ylamino)methyl]pyridin-2-amine

5-chloro-N-(2,2-dimethylpropyl)-N-methyl-6-[(propan-2-ylamino)methyl]pyridin-2-amine (PubChem CID 62288309) has the molecular formula C15H26ClN3 and a molecular weight of 283.85 g/mol. Its IUPAC name is 5-chloro-N-(2,2-dimethylpropyl)-N-methyl-6-[(propan-2-ylamino)methyl]pyridin-2-amine.

Molecular Properties

Compound Name5-chloro-N-(2,2-dimethylpropyl)-N-methyl-6-[(propan-2-ylamino)methyl]pyridin-2-amine
PubChem CID62288309
Molecular FormulaC15H26ClN3
Molecular Weight283.85 g/mol
Exact Mass283.18
IUPAC Name5-chloro-N-(2,2-dimethylpropyl)-N-methyl-6-[(propan-2-ylamino)methyl]pyridin-2-amine
SMILESCC(C)NCc1nc(N(C)CC(C)(C)C)ccc1Cl
InChIInChI=1S/C15H26ClN3/c1-11(2)17-9-13-12(16)7-8-14(18-13)19(6)10-15(3,4)5/h7-8,11,17H,9-10H2,1-6H3
InChIKeyPOMXWGRMLLWKEY-UHFFFAOYSA-N
XLogP3.72
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.85
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-N-(2,2-dimethylpropyl)-N-methyl-6-[(2-methylpropylamino)methyl]pyridin-2-amine
CID 62288482
5-chloro-N-methyl-N-(2-methylpropyl)-6-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 62279898
5-chloro-N-methyl-N-(oxolan-2-ylmethyl)-6-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 62293192
5-chloro-N-ethyl-N-(2-methylpropyl)-6-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 62280062
N,N-dibutyl-5-chloro-6-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 63489625
5-chloro-N-methyl-N-(oxan-3-ylmethyl)-6-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 63708108
5-chloro-N-methyl-N-(3-methylcyclohexyl)-6-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 62283930
6-[(tert-butylamino)methyl]-5-chloro-N-(cyclopropylmethyl)-N-methylpyridin-2-amine
CID 62283149
5-chloro-N-(3-methyl-2-propan-2-ylbutyl)-6-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 102915273
N'-[6-[(tert-butylamino)methyl]-5-chloro-2-pyridinyl]-N,N,N'-trimethylpropane-1,3-diamine
CID 63699864
N-[[3-chloro-6-(1,1,1-trifluoropropan-2-yloxy)-2-pyridinyl]methyl]propan-2-amine
CID 66275955
2-chloro-N-(2,2-dimethylpropyl)-N-methylpyrimidin-4-amine
CID 62342868

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2,2-dimethylpropyl)-N-methyl-6-[(propan-2-ylamino)methyl]pyridin-2-amine?
The IUPAC name of 5-chloro-N-(2,2-dimethylpropyl)-N-methyl-6-[(propan-2-ylamino)methyl]pyridin-2-amine (CID 62288309) is 5-chloro-N-(2,2-dimethylpropyl)-N-methyl-6-[(propan-2-ylamino)methyl]pyridin-2-amine.
What is the SMILES notation for 5-chloro-N-(2,2-dimethylpropyl)-N-methyl-6-[(propan-2-ylamino)methyl]pyridin-2-amine?
The canonical SMILES for 5-chloro-N-(2,2-dimethylpropyl)-N-methyl-6-[(propan-2-ylamino)methyl]pyridin-2-amine is CC(C)NCc1nc(N(C)CC(C)(C)C)ccc1Cl.
What is the InChIKey of 5-chloro-N-(2,2-dimethylpropyl)-N-methyl-6-[(propan-2-ylamino)methyl]pyridin-2-amine?
The InChIKey is POMXWGRMLLWKEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26ClN3/c1-11(2)17-9-13-12(16)7-8-14(18-13)19(6)10-15(3,4)5/h7-8,11,17H,9-10H2,1-6H3.
What are the key properties of 5-chloro-N-(2,2-dimethylpropyl)-N-methyl-6-[(propan-2-ylamino)methyl]pyridin-2-amine?
5-chloro-N-(2,2-dimethylpropyl)-N-methyl-6-[(propan-2-ylamino)methyl]pyridin-2-amine has a molecular weight of 283.85 g/mol, XLogP of 3.72, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2,2-dimethylpropyl)-N-methyl-6-[(propan-2-ylamino)methyl]pyridin-2-amine is sourced from PubChem (CID 62288309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).